USER MOD reduce.3.24.130724 H: found=0, std=0, add=920, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 926 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 102 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 69 MET CE :methyl -143:sc= -4.11! (180deg=-4.7!) USER MOD Set 2.1: A 100 THR OG1 : rot -102:sc= 0.966 USER MOD Set 2.2: B 100 THR OG1 : rot 130:sc= -0.778 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl 163:sc= -9.56! (180deg=-10.7!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 MET CE :methyl -166:sc= -0.0424 (180deg=-0.377) USER MOD Single : A 83 SER OG : rot -90:sc= -1.59 USER MOD Single : A 86 ASN : amide:sc= -0.018 K(o=-0.018,f=-2.5!) USER MOD Single : A 88 MET CE :methyl 160:sc= -0.148 (180deg=-0.655) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -156:sc= 0.888 (180deg=0.397) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -108:sc= -0.0987 (180deg=-1.63!) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc= -0.271 X(o=-0.27,f=-0.31) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 82 MET CE :methyl 165:sc= -0.0861 (180deg=-0.464) USER MOD Single : B 83 SER OG : rot -130:sc= -0.563 USER MOD Single : B 86 ASN : amide:sc= 0.00477 K(o=0.0048,f=-2.5!) USER MOD Single : B 88 MET CE :methyl 159:sc= -0.18 (180deg=-0.755) USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 LYS NZ :NH3+ -107:sc= 0.449 (180deg=-0.0624) USER MOD Single : B 96 TYR OH : rot 180:sc= 0 USER MOD Single : B 98 LYS NZ :NH3+ -110:sc= -0.127 (180deg=-1.57) USER MOD Single : B 102 THR OG1 : rot 92:sc= 0.627 USER MOD Single : B 106 SER OG : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 116 HIS : no HD1:sc= -0.442 X(o=-0.44,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 61 10.498 -9.032 13.015 1.00 0.00 N ATOM 2 CA ALA A 61 9.745 -9.892 12.065 1.00 0.00 C ATOM 3 C ALA A 61 10.333 -9.816 10.667 1.00 0.00 C ATOM 4 O ALA A 61 10.699 -8.738 10.195 1.00 0.00 O ATOM 5 CB ALA A 61 8.284 -9.483 12.011 1.00 0.00 C ATOM 0 HA ALA A 61 9.823 -10.917 12.427 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.752 -10.126 11.310 1.00 0.00 H new ATOM 0 HB2 ALA A 61 7.841 -9.583 13.002 1.00 0.00 H new ATOM 0 HB3 ALA A 61 8.208 -8.446 11.683 1.00 0.00 H new ATOM 13 N SER A 62 10.398 -10.959 9.996 1.00 0.00 N ATOM 14 CA SER A 62 10.913 -11.005 8.641 1.00 0.00 C ATOM 15 C SER A 62 10.056 -10.138 7.740 1.00 0.00 C ATOM 16 O SER A 62 8.845 -10.025 7.933 1.00 0.00 O ATOM 17 CB SER A 62 10.924 -12.434 8.117 1.00 0.00 C ATOM 18 OG SER A 62 11.578 -13.310 9.019 1.00 0.00 O ATOM 0 H SER A 62 10.101 -11.861 10.369 1.00 0.00 H new ATOM 0 HA SER A 62 11.936 -10.629 8.646 1.00 0.00 H new ATOM 0 HB2 SER A 62 9.900 -12.772 7.957 1.00 0.00 H new ATOM 0 HB3 SER A 62 11.425 -12.465 7.150 1.00 0.00 H new ATOM 0 HG SER A 62 11.568 -14.220 8.656 1.00 0.00 H new ATOM 24 N ASP A 63 10.694 -9.523 6.770 1.00 0.00 N ATOM 25 CA ASP A 63 10.007 -8.649 5.840 1.00 0.00 C ATOM 26 C ASP A 63 9.202 -9.448 4.820 1.00 0.00 C ATOM 27 O ASP A 63 8.157 -8.996 4.356 1.00 0.00 O ATOM 28 CB ASP A 63 11.013 -7.739 5.140 1.00 0.00 C ATOM 29 CG ASP A 63 11.759 -6.842 6.109 1.00 0.00 C ATOM 30 OD1 ASP A 63 11.488 -6.925 7.326 1.00 0.00 O ATOM 31 OD2 ASP A 63 12.613 -6.055 5.651 1.00 0.00 O ATOM 0 H ASP A 63 11.696 -9.612 6.602 1.00 0.00 H new ATOM 0 HA ASP A 63 9.305 -8.034 6.403 1.00 0.00 H new ATOM 0 HB2 ASP A 63 11.729 -8.350 4.591 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.492 -7.123 4.407 1.00 0.00 H new ATOM 36 N ASP A 64 9.694 -10.634 4.472 1.00 0.00 N ATOM 37 CA ASP A 64 9.026 -11.486 3.511 1.00 0.00 C ATOM 38 C ASP A 64 7.590 -11.748 3.915 1.00 0.00 C ATOM 39 O ASP A 64 6.700 -11.760 3.070 1.00 0.00 O ATOM 40 CB ASP A 64 9.778 -12.803 3.381 1.00 0.00 C ATOM 41 CG ASP A 64 11.275 -12.609 3.236 1.00 0.00 C ATOM 42 OD1 ASP A 64 11.697 -11.980 2.245 1.00 0.00 O ATOM 43 OD2 ASP A 64 12.024 -13.086 4.115 1.00 0.00 O ATOM 0 H ASP A 64 10.559 -11.023 4.848 1.00 0.00 H new ATOM 0 HA ASP A 64 9.018 -10.974 2.549 1.00 0.00 H new ATOM 0 HB2 ASP A 64 9.579 -13.419 4.258 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.401 -13.348 2.516 1.00 0.00 H new ATOM 48 N GLU A 65 7.364 -11.957 5.201 1.00 0.00 N ATOM 49 CA GLU A 65 6.027 -12.210 5.683 1.00 0.00 C ATOM 50 C GLU A 65 5.101 -11.072 5.269 1.00 0.00 C ATOM 51 O GLU A 65 3.923 -11.280 4.976 1.00 0.00 O ATOM 52 CB GLU A 65 6.026 -12.385 7.204 1.00 0.00 C ATOM 53 CG GLU A 65 4.646 -12.639 7.788 1.00 0.00 C ATOM 54 CD GLU A 65 4.679 -12.841 9.291 1.00 0.00 C ATOM 55 OE1 GLU A 65 5.309 -13.820 9.744 1.00 0.00 O ATOM 56 OE2 GLU A 65 4.078 -12.021 10.014 1.00 0.00 O ATOM 0 H GLU A 65 8.086 -11.956 5.921 1.00 0.00 H new ATOM 0 HA GLU A 65 5.662 -13.136 5.238 1.00 0.00 H new ATOM 0 HB2 GLU A 65 6.680 -13.216 7.466 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.447 -11.491 7.664 1.00 0.00 H new ATOM 0 HG2 GLU A 65 3.995 -11.797 7.552 1.00 0.00 H new ATOM 0 HG3 GLU A 65 4.212 -13.520 7.316 1.00 0.00 H new ATOM 63 N LEU A 66 5.662 -9.870 5.231 1.00 0.00 N ATOM 64 CA LEU A 66 4.929 -8.673 4.836 1.00 0.00 C ATOM 65 C LEU A 66 4.741 -8.640 3.328 1.00 0.00 C ATOM 66 O LEU A 66 3.667 -8.344 2.821 1.00 0.00 O ATOM 67 CB LEU A 66 5.695 -7.423 5.270 1.00 0.00 C ATOM 68 CG LEU A 66 5.625 -7.078 6.763 1.00 0.00 C ATOM 69 CD1 LEU A 66 5.948 -8.287 7.629 1.00 0.00 C ATOM 70 CD2 LEU A 66 6.561 -5.924 7.086 1.00 0.00 C ATOM 0 H LEU A 66 6.638 -9.697 5.473 1.00 0.00 H new ATOM 0 HA LEU A 66 3.953 -8.693 5.321 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.742 -7.549 4.995 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.316 -6.573 4.702 1.00 0.00 H new ATOM 0 HG LEU A 66 4.603 -6.773 6.988 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.889 -8.007 8.681 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.232 -9.083 7.425 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.955 -8.638 7.403 1.00 0.00 H new ATOM 0 HD21 LEU A 66 6.499 -5.692 8.149 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.584 -6.204 6.835 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.272 -5.048 6.506 1.00 0.00 H new ATOM 82 N PHE A 67 5.811 -8.927 2.619 1.00 0.00 N ATOM 83 CA PHE A 67 5.790 -8.923 1.173 1.00 0.00 C ATOM 84 C PHE A 67 5.006 -10.104 0.625 1.00 0.00 C ATOM 85 O PHE A 67 4.595 -10.107 -0.535 1.00 0.00 O ATOM 86 CB PHE A 67 7.220 -8.929 0.665 1.00 0.00 C ATOM 87 CG PHE A 67 7.991 -7.742 1.143 1.00 0.00 C ATOM 88 CD1 PHE A 67 7.457 -6.469 1.040 1.00 0.00 C ATOM 89 CD2 PHE A 67 9.241 -7.899 1.713 1.00 0.00 C ATOM 90 CE1 PHE A 67 8.162 -5.373 1.495 1.00 0.00 C ATOM 91 CE2 PHE A 67 9.951 -6.809 2.164 1.00 0.00 C ATOM 92 CZ PHE A 67 9.415 -5.546 2.055 1.00 0.00 C ATOM 0 H PHE A 67 6.715 -9.168 3.026 1.00 0.00 H new ATOM 0 HA PHE A 67 5.284 -8.023 0.823 1.00 0.00 H new ATOM 0 HB2 PHE A 67 7.718 -9.841 0.995 1.00 0.00 H new ATOM 0 HB3 PHE A 67 7.217 -8.944 -0.425 1.00 0.00 H new ATOM 0 HD1 PHE A 67 6.480 -6.332 0.600 1.00 0.00 H new ATOM 0 HD2 PHE A 67 9.665 -8.888 1.805 1.00 0.00 H new ATOM 0 HE1 PHE A 67 7.737 -4.384 1.414 1.00 0.00 H new ATOM 0 HE2 PHE A 67 10.928 -6.945 2.603 1.00 0.00 H new ATOM 0 HZ PHE A 67 9.972 -4.690 2.407 1.00 0.00 H new ATOM 102 N SER A 68 4.800 -11.105 1.468 1.00 0.00 N ATOM 103 CA SER A 68 4.062 -12.295 1.070 1.00 0.00 C ATOM 104 C SER A 68 2.585 -11.981 0.893 1.00 0.00 C ATOM 105 O SER A 68 1.994 -12.304 -0.133 1.00 0.00 O ATOM 106 CB SER A 68 4.244 -13.390 2.107 1.00 0.00 C ATOM 107 OG SER A 68 3.515 -14.555 1.760 1.00 0.00 O ATOM 0 H SER A 68 5.133 -11.117 2.432 1.00 0.00 H new ATOM 0 HA SER A 68 4.455 -12.640 0.114 1.00 0.00 H new ATOM 0 HB2 SER A 68 5.302 -13.635 2.199 1.00 0.00 H new ATOM 0 HB3 SER A 68 3.915 -13.029 3.081 1.00 0.00 H new ATOM 0 HG SER A 68 3.652 -15.243 2.444 1.00 0.00 H new ATOM 113 N MET A 69 1.992 -11.335 1.887 1.00 0.00 N ATOM 114 CA MET A 69 0.596 -10.967 1.802 1.00 0.00 C ATOM 115 C MET A 69 0.378 -10.158 0.532 1.00 0.00 C ATOM 116 O MET A 69 -0.632 -10.304 -0.150 1.00 0.00 O ATOM 117 CB MET A 69 0.172 -10.159 3.028 1.00 0.00 C ATOM 118 CG MET A 69 1.248 -9.213 3.509 1.00 0.00 C ATOM 119 SD MET A 69 0.650 -7.969 4.656 1.00 0.00 S ATOM 120 CE MET A 69 2.058 -6.871 4.629 1.00 0.00 C ATOM 0 H MET A 69 2.456 -11.059 2.753 1.00 0.00 H new ATOM 0 HA MET A 69 -0.014 -11.870 1.773 1.00 0.00 H new ATOM 0 HB2 MET A 69 -0.726 -9.589 2.789 1.00 0.00 H new ATOM 0 HB3 MET A 69 -0.091 -10.843 3.835 1.00 0.00 H new ATOM 0 HG2 MET A 69 2.038 -9.789 3.990 1.00 0.00 H new ATOM 0 HG3 MET A 69 1.695 -8.716 2.648 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.770 -5.900 5.033 1.00 0.00 H new ATOM 0 HE2 MET A 69 2.860 -7.293 5.235 1.00 0.00 H new ATOM 0 HE3 MET A 69 2.404 -6.749 3.603 1.00 0.00 H new ATOM 130 N LEU A 70 1.365 -9.326 0.209 1.00 0.00 N ATOM 131 CA LEU A 70 1.327 -8.505 -0.987 1.00 0.00 C ATOM 132 C LEU A 70 1.354 -9.401 -2.203 1.00 0.00 C ATOM 133 O LEU A 70 0.738 -9.117 -3.221 1.00 0.00 O ATOM 134 CB LEU A 70 2.519 -7.559 -0.970 1.00 0.00 C ATOM 135 CG LEU A 70 2.648 -6.801 0.331 1.00 0.00 C ATOM 136 CD1 LEU A 70 3.995 -6.125 0.431 1.00 0.00 C ATOM 137 CD2 LEU A 70 1.521 -5.805 0.435 1.00 0.00 C ATOM 0 H LEU A 70 2.208 -9.206 0.770 1.00 0.00 H new ATOM 0 HA LEU A 70 0.413 -7.912 -1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.432 -8.129 -1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 70 2.425 -6.848 -1.791 1.00 0.00 H new ATOM 0 HG LEU A 70 2.580 -7.499 1.166 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.063 -5.586 1.376 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.783 -6.876 0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.112 -5.424 -0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.608 -5.254 1.372 1.00 0.00 H new ATOM 0 HD22 LEU A 70 1.573 -5.108 -0.402 1.00 0.00 H new ATOM 0 HD23 LEU A 70 0.567 -6.331 0.411 1.00 0.00 H new ATOM 149 N ASP A 71 2.061 -10.506 -2.062 1.00 0.00 N ATOM 150 CA ASP A 71 2.166 -11.488 -3.121 1.00 0.00 C ATOM 151 C ASP A 71 0.785 -12.011 -3.479 1.00 0.00 C ATOM 152 O ASP A 71 0.486 -12.268 -4.645 1.00 0.00 O ATOM 153 CB ASP A 71 3.067 -12.639 -2.668 1.00 0.00 C ATOM 154 CG ASP A 71 3.271 -13.683 -3.749 1.00 0.00 C ATOM 155 OD1 ASP A 71 3.796 -13.329 -4.826 1.00 0.00 O ATOM 156 OD2 ASP A 71 2.906 -14.856 -3.519 1.00 0.00 O ATOM 0 H ASP A 71 2.576 -10.746 -1.215 1.00 0.00 H new ATOM 0 HA ASP A 71 2.604 -11.022 -4.004 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.036 -12.240 -2.367 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.630 -13.113 -1.789 1.00 0.00 H new ATOM 161 N GLN A 72 -0.050 -12.175 -2.462 1.00 0.00 N ATOM 162 CA GLN A 72 -1.397 -12.677 -2.660 1.00 0.00 C ATOM 163 C GLN A 72 -2.334 -11.614 -3.216 1.00 0.00 C ATOM 164 O GLN A 72 -3.164 -11.893 -4.082 1.00 0.00 O ATOM 165 CB GLN A 72 -1.953 -13.231 -1.351 1.00 0.00 C ATOM 166 CG GLN A 72 -3.314 -13.887 -1.502 1.00 0.00 C ATOM 167 CD GLN A 72 -3.849 -14.435 -0.193 1.00 0.00 C ATOM 168 OE1 GLN A 72 -4.027 -13.697 0.776 1.00 0.00 O ATOM 169 NE2 GLN A 72 -4.112 -15.737 -0.160 1.00 0.00 N ATOM 0 H GLN A 72 0.185 -11.967 -1.492 1.00 0.00 H new ATOM 0 HA GLN A 72 -1.336 -13.477 -3.398 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -1.250 -13.959 -0.946 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.027 -12.421 -0.625 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.021 -13.160 -1.902 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -3.244 -14.697 -2.228 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -3.949 -16.311 -0.987 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -4.477 -16.162 0.692 1.00 0.00 H new ATOM 178 N ARG A 73 -2.199 -10.401 -2.713 1.00 0.00 N ATOM 179 CA ARG A 73 -3.038 -9.291 -3.156 1.00 0.00 C ATOM 180 C ARG A 73 -2.666 -8.866 -4.565 1.00 0.00 C ATOM 181 O ARG A 73 -3.527 -8.605 -5.405 1.00 0.00 O ATOM 182 CB ARG A 73 -2.890 -8.105 -2.210 1.00 0.00 C ATOM 183 CG ARG A 73 -3.717 -8.221 -0.934 1.00 0.00 C ATOM 184 CD ARG A 73 -3.308 -9.419 -0.096 1.00 0.00 C ATOM 185 NE ARG A 73 -4.146 -9.577 1.092 1.00 0.00 N ATOM 186 CZ ARG A 73 -5.449 -9.844 1.052 1.00 0.00 C ATOM 187 NH1 ARG A 73 -6.066 -9.999 -0.112 1.00 0.00 N ATOM 188 NH2 ARG A 73 -6.136 -9.964 2.180 1.00 0.00 N ATOM 0 H ARG A 73 -1.517 -10.154 -1.996 1.00 0.00 H new ATOM 0 HA ARG A 73 -4.075 -9.628 -3.151 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.839 -7.997 -1.941 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.179 -7.195 -2.736 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.603 -7.311 -0.345 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -4.773 -8.303 -1.193 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -3.368 -10.322 -0.703 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -2.267 -9.309 0.208 1.00 0.00 H new ATOM 0 HE ARG A 73 -3.705 -9.476 2.006 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -5.541 -9.914 -0.983 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -7.065 -10.204 -0.136 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.666 -9.852 3.078 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.135 -10.169 2.150 1.00 0.00 H new ATOM 202 N PHE A 74 -1.370 -8.808 -4.805 1.00 0.00 N ATOM 203 CA PHE A 74 -0.838 -8.424 -6.099 1.00 0.00 C ATOM 204 C PHE A 74 -1.094 -9.529 -7.112 1.00 0.00 C ATOM 205 O PHE A 74 -1.059 -9.305 -8.322 1.00 0.00 O ATOM 206 CB PHE A 74 0.667 -8.169 -5.987 1.00 0.00 C ATOM 207 CG PHE A 74 1.053 -6.978 -5.147 1.00 0.00 C ATOM 208 CD1 PHE A 74 0.134 -6.328 -4.325 1.00 0.00 C ATOM 209 CD2 PHE A 74 2.353 -6.504 -5.186 1.00 0.00 C ATOM 210 CE1 PHE A 74 0.515 -5.240 -3.567 1.00 0.00 C ATOM 211 CE2 PHE A 74 2.733 -5.417 -4.430 1.00 0.00 C ATOM 212 CZ PHE A 74 1.815 -4.786 -3.622 1.00 0.00 C ATOM 0 H PHE A 74 -0.657 -9.026 -4.109 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.334 -7.512 -6.430 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.140 -9.058 -5.569 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.072 -8.034 -6.990 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -0.886 -6.679 -4.281 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.079 -6.993 -5.818 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.204 -4.745 -2.932 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.751 -5.060 -4.471 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.114 -3.934 -3.030 1.00 0.00 H new ATOM 222 N GLY A 75 -1.340 -10.727 -6.595 1.00 0.00 N ATOM 223 CA GLY A 75 -1.590 -11.872 -7.451 1.00 0.00 C ATOM 224 C GLY A 75 -2.861 -11.735 -8.266 1.00 0.00 C ATOM 225 O GLY A 75 -2.856 -11.970 -9.475 1.00 0.00 O ATOM 0 H GLY A 75 -1.371 -10.926 -5.595 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.745 -12.006 -8.126 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.653 -12.771 -6.837 1.00 0.00 H new ATOM 229 N GLY A 76 -3.951 -11.359 -7.604 1.00 0.00 N ATOM 230 CA GLY A 76 -5.220 -11.204 -8.288 1.00 0.00 C ATOM 231 C GLY A 76 -5.900 -12.534 -8.564 1.00 0.00 C ATOM 232 O GLY A 76 -7.096 -12.687 -8.321 1.00 0.00 O ATOM 0 H GLY A 76 -3.977 -11.159 -6.604 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.880 -10.581 -7.685 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.059 -10.680 -9.230 1.00 0.00 H new ATOM 236 N GLY A 77 -5.133 -13.496 -9.067 1.00 0.00 N ATOM 237 CA GLY A 77 -5.681 -14.808 -9.364 1.00 0.00 C ATOM 238 C GLY A 77 -4.669 -15.713 -10.035 1.00 0.00 C ATOM 239 O GLY A 77 -4.975 -16.367 -11.031 1.00 0.00 O ATOM 0 H GLY A 77 -4.140 -13.391 -9.275 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.026 -15.273 -8.441 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.552 -14.698 -10.010 1.00 0.00 H new ATOM 243 N GLU A 78 -3.467 -15.751 -9.471 1.00 0.00 N ATOM 244 CA GLU A 78 -2.384 -16.576 -9.991 1.00 0.00 C ATOM 245 C GLU A 78 -2.070 -16.271 -11.448 1.00 0.00 C ATOM 246 O GLU A 78 -2.894 -15.730 -12.185 1.00 0.00 O ATOM 247 CB GLU A 78 -2.704 -18.054 -9.824 1.00 0.00 C ATOM 248 CG GLU A 78 -2.902 -18.443 -8.375 1.00 0.00 C ATOM 249 CD GLU A 78 -4.232 -17.977 -7.816 1.00 0.00 C ATOM 250 OE1 GLU A 78 -5.280 -18.383 -8.360 1.00 0.00 O ATOM 251 OE2 GLU A 78 -4.225 -17.206 -6.834 1.00 0.00 O ATOM 0 H GLU A 78 -3.217 -15.212 -8.642 1.00 0.00 H new ATOM 0 HA GLU A 78 -1.496 -16.333 -9.407 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.606 -18.293 -10.388 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.895 -18.648 -10.249 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -2.834 -19.527 -8.282 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -2.094 -18.021 -7.777 1.00 0.00 H new ATOM 258 N ASP A 79 -0.855 -16.626 -11.842 1.00 0.00 N ATOM 259 CA ASP A 79 -0.382 -16.404 -13.208 1.00 0.00 C ATOM 260 C ASP A 79 1.073 -16.800 -13.333 1.00 0.00 C ATOM 261 O ASP A 79 1.436 -17.739 -14.041 1.00 0.00 O ATOM 262 CB ASP A 79 -0.524 -14.930 -13.583 1.00 0.00 C ATOM 263 CG ASP A 79 -0.280 -14.675 -15.058 1.00 0.00 C ATOM 264 OD1 ASP A 79 0.819 -15.011 -15.546 1.00 0.00 O ATOM 265 OD2 ASP A 79 -1.188 -14.135 -15.725 1.00 0.00 O ATOM 0 H ASP A 79 -0.171 -17.073 -11.231 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.986 -17.015 -13.879 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -1.525 -14.587 -13.320 1.00 0.00 H new ATOM 0 HB3 ASP A 79 0.180 -14.340 -12.995 1.00 0.00 H new ATOM 270 N LEU A 80 1.891 -16.048 -12.631 1.00 0.00 N ATOM 271 CA LEU A 80 3.334 -16.251 -12.616 1.00 0.00 C ATOM 272 C LEU A 80 3.694 -17.644 -12.109 1.00 0.00 C ATOM 273 O LEU A 80 3.069 -18.163 -11.183 1.00 0.00 O ATOM 274 CB LEU A 80 3.997 -15.184 -11.749 1.00 0.00 C ATOM 275 CG LEU A 80 3.728 -13.745 -12.197 1.00 0.00 C ATOM 276 CD1 LEU A 80 4.154 -12.760 -11.123 1.00 0.00 C ATOM 277 CD2 LEU A 80 4.444 -13.453 -13.506 1.00 0.00 C ATOM 0 H LEU A 80 1.578 -15.272 -12.048 1.00 0.00 H new ATOM 0 HA LEU A 80 3.701 -16.165 -13.639 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.651 -15.302 -10.722 1.00 0.00 H new ATOM 0 HB3 LEU A 80 5.074 -15.355 -11.745 1.00 0.00 H new ATOM 0 HG LEU A 80 2.656 -13.630 -12.358 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.954 -11.743 -11.462 1.00 0.00 H new ATOM 0 HD12 LEU A 80 3.594 -12.954 -10.208 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.220 -12.874 -10.927 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.242 -12.426 -13.810 1.00 0.00 H new ATOM 0 HD22 LEU A 80 5.517 -13.587 -13.371 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.087 -14.136 -14.276 1.00 0.00 H new ATOM 289 N LEU A 81 4.708 -18.242 -12.727 1.00 0.00 N ATOM 290 CA LEU A 81 5.164 -19.566 -12.363 1.00 0.00 C ATOM 291 C LEU A 81 5.769 -19.580 -10.962 1.00 0.00 C ATOM 292 O LEU A 81 5.537 -20.507 -10.184 1.00 0.00 O ATOM 293 CB LEU A 81 6.196 -20.044 -13.384 1.00 0.00 C ATOM 294 CG LEU A 81 5.657 -20.337 -14.791 1.00 0.00 C ATOM 295 CD1 LEU A 81 4.512 -21.339 -14.730 1.00 0.00 C ATOM 296 CD2 LEU A 81 5.215 -19.055 -15.481 1.00 0.00 C ATOM 0 H LEU A 81 5.232 -17.817 -13.492 1.00 0.00 H new ATOM 0 HA LEU A 81 4.306 -20.239 -12.361 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.977 -19.288 -13.465 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.667 -20.949 -13.000 1.00 0.00 H new ATOM 0 HG LEU A 81 6.464 -20.775 -15.378 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.144 -21.533 -15.738 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.866 -22.270 -14.288 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.705 -20.932 -14.121 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.837 -19.289 -16.476 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.427 -18.580 -14.896 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.064 -18.376 -15.566 1.00 0.00 H new ATOM 308 N MET A 82 6.549 -18.550 -10.648 1.00 0.00 N ATOM 309 CA MET A 82 7.193 -18.447 -9.342 1.00 0.00 C ATOM 310 C MET A 82 7.701 -17.032 -9.099 1.00 0.00 C ATOM 311 O MET A 82 7.431 -16.434 -8.057 1.00 0.00 O ATOM 312 CB MET A 82 8.366 -19.424 -9.254 1.00 0.00 C ATOM 313 CG MET A 82 9.042 -19.445 -7.892 1.00 0.00 C ATOM 314 SD MET A 82 10.696 -20.164 -7.944 1.00 0.00 S ATOM 315 CE MET A 82 10.390 -21.678 -8.848 1.00 0.00 C ATOM 0 H MET A 82 6.751 -17.775 -11.280 1.00 0.00 H new ATOM 0 HA MET A 82 6.452 -18.694 -8.581 1.00 0.00 H new ATOM 0 HB2 MET A 82 8.010 -20.427 -9.489 1.00 0.00 H new ATOM 0 HB3 MET A 82 9.104 -19.162 -10.012 1.00 0.00 H new ATOM 0 HG2 MET A 82 9.105 -18.427 -7.507 1.00 0.00 H new ATOM 0 HG3 MET A 82 8.426 -20.012 -7.194 1.00 0.00 H new ATOM 0 HE1 MET A 82 11.249 -22.342 -8.747 1.00 0.00 H new ATOM 0 HE2 MET A 82 9.503 -22.168 -8.447 1.00 0.00 H new ATOM 0 HE3 MET A 82 10.232 -21.447 -9.901 1.00 0.00 H new ATOM 325 N SER A 83 8.444 -16.512 -10.072 1.00 0.00 N ATOM 326 CA SER A 83 9.009 -15.168 -9.983 1.00 0.00 C ATOM 327 C SER A 83 10.046 -15.082 -8.868 1.00 0.00 C ATOM 328 O SER A 83 9.891 -15.692 -7.809 1.00 0.00 O ATOM 329 CB SER A 83 7.908 -14.130 -9.755 1.00 0.00 C ATOM 330 OG SER A 83 6.971 -14.138 -10.818 1.00 0.00 O ATOM 0 H SER A 83 8.670 -17.004 -10.936 1.00 0.00 H new ATOM 0 HA SER A 83 9.502 -14.953 -10.931 1.00 0.00 H new ATOM 0 HB2 SER A 83 7.397 -14.338 -8.815 1.00 0.00 H new ATOM 0 HB3 SER A 83 8.352 -13.139 -9.665 1.00 0.00 H new ATOM 0 HG SER A 83 7.257 -13.507 -11.511 1.00 0.00 H new ATOM 336 N GLY A 84 11.105 -14.321 -9.116 1.00 0.00 N ATOM 337 CA GLY A 84 12.158 -14.167 -8.129 1.00 0.00 C ATOM 338 C GLY A 84 13.190 -13.138 -8.543 1.00 0.00 C ATOM 339 O GLY A 84 13.587 -13.079 -9.707 1.00 0.00 O ATOM 0 H GLY A 84 11.254 -13.807 -9.984 1.00 0.00 H new ATOM 0 HA2 GLY A 84 11.719 -13.874 -7.175 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.649 -15.127 -7.972 1.00 0.00 H new ATOM 343 N ASP A 85 13.625 -12.324 -7.586 1.00 0.00 N ATOM 344 CA ASP A 85 14.614 -11.288 -7.851 1.00 0.00 C ATOM 345 C ASP A 85 15.455 -11.015 -6.612 1.00 0.00 C ATOM 346 O ASP A 85 15.579 -9.874 -6.165 1.00 0.00 O ATOM 347 CB ASP A 85 13.930 -10.000 -8.317 1.00 0.00 C ATOM 348 CG ASP A 85 13.178 -10.179 -9.620 1.00 0.00 C ATOM 349 OD1 ASP A 85 13.826 -10.481 -10.643 1.00 0.00 O ATOM 350 OD2 ASP A 85 11.939 -10.019 -9.617 1.00 0.00 O ATOM 0 H ASP A 85 13.306 -12.363 -6.618 1.00 0.00 H new ATOM 0 HA ASP A 85 15.272 -11.643 -8.644 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.238 -9.661 -7.546 1.00 0.00 H new ATOM 0 HB3 ASP A 85 14.680 -9.218 -8.439 1.00 0.00 H new ATOM 355 N ASN A 86 16.031 -12.077 -6.064 1.00 0.00 N ATOM 356 CA ASN A 86 16.867 -11.971 -4.874 1.00 0.00 C ATOM 357 C ASN A 86 18.092 -11.103 -5.145 1.00 0.00 C ATOM 358 O ASN A 86 18.735 -11.227 -6.188 1.00 0.00 O ATOM 359 CB ASN A 86 17.303 -13.360 -4.406 1.00 0.00 C ATOM 360 CG ASN A 86 16.124 -14.248 -4.054 1.00 0.00 C ATOM 361 OD1 ASN A 86 15.271 -14.530 -4.897 1.00 0.00 O ATOM 362 ND2 ASN A 86 16.070 -14.694 -2.805 1.00 0.00 N ATOM 0 H ASN A 86 15.934 -13.026 -6.426 1.00 0.00 H new ATOM 0 HA ASN A 86 16.278 -11.500 -4.087 1.00 0.00 H new ATOM 0 HB2 ASN A 86 17.892 -13.836 -5.190 1.00 0.00 H new ATOM 0 HB3 ASN A 86 17.952 -13.260 -3.536 1.00 0.00 H new ATOM 0 HD21 ASN A 86 15.300 -15.295 -2.511 1.00 0.00 H new ATOM 0 HD22 ASN A 86 16.798 -14.436 -2.139 1.00 0.00 H new ATOM 369 N GLY A 87 18.409 -10.226 -4.199 1.00 0.00 N ATOM 370 CA GLY A 87 19.555 -9.348 -4.348 1.00 0.00 C ATOM 371 C GLY A 87 19.795 -8.503 -3.113 1.00 0.00 C ATOM 372 O GLY A 87 20.923 -8.401 -2.631 1.00 0.00 O ATOM 0 H GLY A 87 17.891 -10.107 -3.329 1.00 0.00 H new ATOM 0 HA2 GLY A 87 20.443 -9.945 -4.556 1.00 0.00 H new ATOM 0 HA3 GLY A 87 19.401 -8.696 -5.208 1.00 0.00 H new ATOM 376 N MET A 88 18.725 -7.905 -2.599 1.00 0.00 N ATOM 377 CA MET A 88 18.809 -7.067 -1.408 1.00 0.00 C ATOM 378 C MET A 88 17.435 -6.607 -0.959 1.00 0.00 C ATOM 379 O MET A 88 16.450 -6.726 -1.688 1.00 0.00 O ATOM 380 CB MET A 88 19.688 -5.842 -1.646 1.00 0.00 C ATOM 381 CG MET A 88 19.366 -5.101 -2.932 1.00 0.00 C ATOM 382 SD MET A 88 20.424 -3.664 -3.193 1.00 0.00 S ATOM 383 CE MET A 88 22.032 -4.445 -3.316 1.00 0.00 C ATOM 0 H MET A 88 17.786 -7.986 -2.990 1.00 0.00 H new ATOM 0 HA MET A 88 19.257 -7.681 -0.626 1.00 0.00 H new ATOM 0 HB2 MET A 88 19.577 -5.157 -0.805 1.00 0.00 H new ATOM 0 HB3 MET A 88 20.732 -6.154 -1.668 1.00 0.00 H new ATOM 0 HG2 MET A 88 19.472 -5.783 -3.776 1.00 0.00 H new ATOM 0 HG3 MET A 88 18.324 -4.781 -2.911 1.00 0.00 H new ATOM 0 HE1 MET A 88 22.726 -3.771 -3.818 1.00 0.00 H new ATOM 0 HE2 MET A 88 22.404 -4.671 -2.317 1.00 0.00 H new ATOM 0 HE3 MET A 88 21.945 -5.369 -3.888 1.00 0.00 H new ATOM 393 N THR A 89 17.389 -6.073 0.249 1.00 0.00 N ATOM 394 CA THR A 89 16.156 -5.574 0.828 1.00 0.00 C ATOM 395 C THR A 89 15.527 -4.489 -0.047 1.00 0.00 C ATOM 396 O THR A 89 14.324 -4.511 -0.302 1.00 0.00 O ATOM 397 CB THR A 89 16.416 -5.007 2.233 1.00 0.00 C ATOM 398 OG1 THR A 89 16.813 -6.058 3.122 1.00 0.00 O ATOM 399 CG2 THR A 89 15.182 -4.317 2.771 1.00 0.00 C ATOM 0 H THR A 89 18.204 -5.974 0.854 1.00 0.00 H new ATOM 0 HA THR A 89 15.462 -6.412 0.893 1.00 0.00 H new ATOM 0 HB THR A 89 17.219 -4.274 2.162 1.00 0.00 H new ATOM 0 HG1 THR A 89 16.978 -5.687 4.014 1.00 0.00 H new ATOM 0 HG21 THR A 89 15.390 -3.924 3.766 1.00 0.00 H new ATOM 0 HG22 THR A 89 14.905 -3.498 2.108 1.00 0.00 H new ATOM 0 HG23 THR A 89 14.361 -5.032 2.827 1.00 0.00 H new ATOM 407 N GLU A 90 16.349 -3.546 -0.500 1.00 0.00 N ATOM 408 CA GLU A 90 15.883 -2.445 -1.346 1.00 0.00 C ATOM 409 C GLU A 90 15.081 -2.945 -2.540 1.00 0.00 C ATOM 410 O GLU A 90 13.940 -2.542 -2.731 1.00 0.00 O ATOM 411 CB GLU A 90 17.078 -1.647 -1.851 1.00 0.00 C ATOM 412 CG GLU A 90 17.730 -0.783 -0.786 1.00 0.00 C ATOM 413 CD GLU A 90 18.941 -0.033 -1.302 1.00 0.00 C ATOM 414 OE1 GLU A 90 19.896 -0.693 -1.765 1.00 0.00 O ATOM 415 OE2 GLU A 90 18.937 1.215 -1.242 1.00 0.00 O ATOM 0 H GLU A 90 17.348 -3.521 -0.295 1.00 0.00 H new ATOM 0 HA GLU A 90 15.232 -1.817 -0.738 1.00 0.00 H new ATOM 0 HB2 GLU A 90 17.821 -2.337 -2.252 1.00 0.00 H new ATOM 0 HB3 GLU A 90 16.756 -1.011 -2.676 1.00 0.00 H new ATOM 0 HG2 GLU A 90 17.000 -0.068 -0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 90 18.027 -1.411 0.054 1.00 0.00 H new ATOM 422 N GLU A 91 15.691 -3.809 -3.345 1.00 0.00 N ATOM 423 CA GLU A 91 15.030 -4.355 -4.534 1.00 0.00 C ATOM 424 C GLU A 91 13.578 -4.690 -4.242 1.00 0.00 C ATOM 425 O GLU A 91 12.676 -4.359 -5.012 1.00 0.00 O ATOM 426 CB GLU A 91 15.759 -5.606 -5.031 1.00 0.00 C ATOM 427 CG GLU A 91 17.179 -5.342 -5.500 1.00 0.00 C ATOM 428 CD GLU A 91 17.888 -6.604 -5.953 1.00 0.00 C ATOM 429 OE1 GLU A 91 17.268 -7.688 -5.899 1.00 0.00 O ATOM 430 OE2 GLU A 91 19.065 -6.509 -6.362 1.00 0.00 O ATOM 0 H GLU A 91 16.642 -4.149 -3.199 1.00 0.00 H new ATOM 0 HA GLU A 91 15.063 -3.592 -5.312 1.00 0.00 H new ATOM 0 HB2 GLU A 91 15.782 -6.344 -4.229 1.00 0.00 H new ATOM 0 HB3 GLU A 91 15.191 -6.044 -5.851 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.159 -4.626 -6.322 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.746 -4.882 -4.690 1.00 0.00 H new ATOM 437 N LYS A 92 13.373 -5.324 -3.109 1.00 0.00 N ATOM 438 CA LYS A 92 12.046 -5.699 -2.655 1.00 0.00 C ATOM 439 C LYS A 92 11.277 -4.431 -2.312 1.00 0.00 C ATOM 440 O LYS A 92 10.163 -4.198 -2.776 1.00 0.00 O ATOM 441 CB LYS A 92 12.192 -6.585 -1.419 1.00 0.00 C ATOM 442 CG LYS A 92 11.017 -7.490 -1.126 1.00 0.00 C ATOM 443 CD LYS A 92 11.467 -8.763 -0.416 1.00 0.00 C ATOM 444 CE LYS A 92 12.431 -8.471 0.727 1.00 0.00 C ATOM 445 NZ LYS A 92 12.814 -9.706 1.464 1.00 0.00 N ATOM 0 H LYS A 92 14.122 -5.596 -2.472 1.00 0.00 H new ATOM 0 HA LYS A 92 11.506 -6.246 -3.428 1.00 0.00 H new ATOM 0 HB2 LYS A 92 13.083 -7.202 -1.538 1.00 0.00 H new ATOM 0 HB3 LYS A 92 12.361 -5.946 -0.553 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.293 -6.961 -0.507 1.00 0.00 H new ATOM 0 HG3 LYS A 92 10.512 -7.748 -2.057 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.595 -9.289 -0.029 1.00 0.00 H new ATOM 0 HD3 LYS A 92 11.947 -9.428 -1.134 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.327 -7.992 0.332 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.971 -7.765 1.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.113 -9.456 2.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 11.999 -10.350 1.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.599 -10.176 0.969 1.00 0.00 H new ATOM 459 N LEU A 93 11.921 -3.608 -1.505 1.00 0.00 N ATOM 460 CA LEU A 93 11.376 -2.336 -1.068 1.00 0.00 C ATOM 461 C LEU A 93 11.029 -1.425 -2.245 1.00 0.00 C ATOM 462 O LEU A 93 10.219 -0.512 -2.112 1.00 0.00 O ATOM 463 CB LEU A 93 12.404 -1.653 -0.170 1.00 0.00 C ATOM 464 CG LEU A 93 12.728 -2.408 1.117 1.00 0.00 C ATOM 465 CD1 LEU A 93 13.515 -1.523 2.063 1.00 0.00 C ATOM 466 CD2 LEU A 93 11.460 -2.905 1.783 1.00 0.00 C ATOM 0 H LEU A 93 12.849 -3.807 -1.130 1.00 0.00 H new ATOM 0 HA LEU A 93 10.450 -2.524 -0.524 1.00 0.00 H new ATOM 0 HB2 LEU A 93 13.325 -1.514 -0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.037 -0.660 0.090 1.00 0.00 H new ATOM 0 HG LEU A 93 13.339 -3.274 0.863 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.739 -2.075 2.976 1.00 0.00 H new ATOM 0 HD12 LEU A 93 14.446 -1.218 1.586 1.00 0.00 H new ATOM 0 HD13 LEU A 93 12.927 -0.639 2.308 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.715 -3.440 2.698 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.820 -2.057 2.025 1.00 0.00 H new ATOM 0 HD23 LEU A 93 10.932 -3.576 1.105 1.00 0.00 H new ATOM 478 N ARG A 94 11.660 -1.664 -3.388 1.00 0.00 N ATOM 479 CA ARG A 94 11.431 -0.847 -4.575 1.00 0.00 C ATOM 480 C ARG A 94 10.095 -1.174 -5.240 1.00 0.00 C ATOM 481 O ARG A 94 9.329 -0.275 -5.582 1.00 0.00 O ATOM 482 CB ARG A 94 12.572 -1.042 -5.575 1.00 0.00 C ATOM 483 CG ARG A 94 12.425 -0.212 -6.841 1.00 0.00 C ATOM 484 CD ARG A 94 13.596 -0.426 -7.788 1.00 0.00 C ATOM 485 NE ARG A 94 13.457 0.347 -9.020 1.00 0.00 N ATOM 486 CZ ARG A 94 12.478 0.165 -9.903 1.00 0.00 C ATOM 487 NH1 ARG A 94 11.560 -0.771 -9.700 1.00 0.00 N ATOM 488 NH2 ARG A 94 12.420 0.916 -10.994 1.00 0.00 N ATOM 0 H ARG A 94 12.335 -2.417 -3.519 1.00 0.00 H new ATOM 0 HA ARG A 94 11.398 0.195 -4.257 1.00 0.00 H new ATOM 0 HB2 ARG A 94 13.515 -0.786 -5.091 1.00 0.00 H new ATOM 0 HB3 ARG A 94 12.629 -2.096 -5.847 1.00 0.00 H new ATOM 0 HG2 ARG A 94 11.495 -0.477 -7.345 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.356 0.844 -6.579 1.00 0.00 H new ATOM 0 HD2 ARG A 94 14.522 -0.145 -7.287 1.00 0.00 H new ATOM 0 HD3 ARG A 94 13.675 -1.485 -8.032 1.00 0.00 H new ATOM 0 HE ARG A 94 14.151 1.069 -9.215 1.00 0.00 H new ATOM 0 HH11 ARG A 94 11.603 -1.355 -8.865 1.00 0.00 H new ATOM 0 HH12 ARG A 94 10.811 -0.907 -10.379 1.00 0.00 H new ATOM 0 HH21 ARG A 94 13.126 1.634 -11.157 1.00 0.00 H new ATOM 0 HH22 ARG A 94 11.669 0.776 -11.670 1.00 0.00 H new ATOM 502 N ARG A 95 9.832 -2.463 -5.437 1.00 0.00 N ATOM 503 CA ARG A 95 8.598 -2.903 -6.083 1.00 0.00 C ATOM 504 C ARG A 95 7.413 -2.914 -5.115 1.00 0.00 C ATOM 505 O ARG A 95 6.390 -2.285 -5.372 1.00 0.00 O ATOM 506 CB ARG A 95 8.796 -4.290 -6.702 1.00 0.00 C ATOM 507 CG ARG A 95 9.420 -5.302 -5.758 1.00 0.00 C ATOM 508 CD ARG A 95 9.645 -6.639 -6.444 1.00 0.00 C ATOM 509 NE ARG A 95 8.403 -7.202 -6.966 1.00 0.00 N ATOM 510 CZ ARG A 95 8.332 -8.364 -7.609 1.00 0.00 C ATOM 511 NH1 ARG A 95 9.428 -9.085 -7.808 1.00 0.00 N ATOM 512 NH2 ARG A 95 7.164 -8.805 -8.055 1.00 0.00 N ATOM 0 H ARG A 95 10.456 -3.221 -5.159 1.00 0.00 H new ATOM 0 HA ARG A 95 8.364 -2.186 -6.870 1.00 0.00 H new ATOM 0 HB2 ARG A 95 7.830 -4.668 -7.038 1.00 0.00 H new ATOM 0 HB3 ARG A 95 9.426 -4.196 -7.586 1.00 0.00 H new ATOM 0 HG2 ARG A 95 10.370 -4.918 -5.387 1.00 0.00 H new ATOM 0 HG3 ARG A 95 8.773 -5.441 -4.892 1.00 0.00 H new ATOM 0 HD2 ARG A 95 10.357 -6.513 -7.260 1.00 0.00 H new ATOM 0 HD3 ARG A 95 10.091 -7.339 -5.737 1.00 0.00 H new ATOM 0 HE ARG A 95 7.541 -6.674 -6.830 1.00 0.00 H new ATOM 0 HH11 ARG A 95 10.329 -8.748 -7.467 1.00 0.00 H new ATOM 0 HH12 ARG A 95 9.370 -9.976 -8.302 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.319 -8.253 -7.905 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.110 -9.696 -8.548 1.00 0.00 H new ATOM 526 N TYR A 96 7.557 -3.634 -4.008 1.00 0.00 N ATOM 527 CA TYR A 96 6.513 -3.741 -3.005 1.00 0.00 C ATOM 528 C TYR A 96 6.015 -2.377 -2.543 1.00 0.00 C ATOM 529 O TYR A 96 4.826 -2.207 -2.300 1.00 0.00 O ATOM 530 CB TYR A 96 7.046 -4.569 -1.844 1.00 0.00 C ATOM 531 CG TYR A 96 7.239 -6.015 -2.229 1.00 0.00 C ATOM 532 CD1 TYR A 96 8.417 -6.438 -2.814 1.00 0.00 C ATOM 533 CD2 TYR A 96 6.230 -6.950 -2.034 1.00 0.00 C ATOM 534 CE1 TYR A 96 8.596 -7.748 -3.196 1.00 0.00 C ATOM 535 CE2 TYR A 96 6.398 -8.268 -2.409 1.00 0.00 C ATOM 536 CZ TYR A 96 7.584 -8.664 -2.992 1.00 0.00 C ATOM 537 OH TYR A 96 7.758 -9.975 -3.371 1.00 0.00 O ATOM 0 H TYR A 96 8.402 -4.159 -3.784 1.00 0.00 H new ATOM 0 HA TYR A 96 5.647 -4.237 -3.443 1.00 0.00 H new ATOM 0 HB2 TYR A 96 7.995 -4.153 -1.507 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.354 -4.506 -1.004 1.00 0.00 H new ATOM 0 HD1 TYR A 96 9.213 -5.726 -2.975 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.299 -6.641 -1.582 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.524 -8.058 -3.653 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.606 -8.984 -2.247 1.00 0.00 H new ATOM 0 HH TYR A 96 6.951 -10.488 -3.156 1.00 0.00 H new ATOM 547 N LEU A 97 6.910 -1.402 -2.425 1.00 0.00 N ATOM 548 CA LEU A 97 6.499 -0.073 -1.993 1.00 0.00 C ATOM 549 C LEU A 97 5.696 0.643 -3.076 1.00 0.00 C ATOM 550 O LEU A 97 4.530 0.977 -2.868 1.00 0.00 O ATOM 551 CB LEU A 97 7.713 0.768 -1.589 1.00 0.00 C ATOM 552 CG LEU A 97 7.396 2.202 -1.147 1.00 0.00 C ATOM 553 CD1 LEU A 97 7.154 3.096 -2.355 1.00 0.00 C ATOM 554 CD2 LEU A 97 6.186 2.217 -0.225 1.00 0.00 C ATOM 0 H LEU A 97 7.906 -1.504 -2.618 1.00 0.00 H new ATOM 0 HA LEU A 97 5.855 -0.197 -1.122 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.232 0.261 -0.776 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.403 0.809 -2.432 1.00 0.00 H new ATOM 0 HG LEU A 97 8.255 2.590 -0.600 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.931 4.109 -2.019 1.00 0.00 H new ATOM 0 HD12 LEU A 97 8.046 3.110 -2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 97 6.312 2.711 -2.930 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.974 3.242 0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.323 1.809 -0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.393 1.611 0.657 1.00 0.00 H new ATOM 566 N LYS A 98 6.321 0.887 -4.225 1.00 0.00 N ATOM 567 CA LYS A 98 5.651 1.580 -5.326 1.00 0.00 C ATOM 568 C LYS A 98 4.332 0.901 -5.659 1.00 0.00 C ATOM 569 O LYS A 98 3.377 1.546 -6.089 1.00 0.00 O ATOM 570 CB LYS A 98 6.546 1.621 -6.567 1.00 0.00 C ATOM 571 CG LYS A 98 6.832 0.252 -7.163 1.00 0.00 C ATOM 572 CD LYS A 98 7.690 0.357 -8.414 1.00 0.00 C ATOM 573 CE LYS A 98 7.953 -1.009 -9.028 1.00 0.00 C ATOM 574 NZ LYS A 98 6.691 -1.694 -9.423 1.00 0.00 N ATOM 0 H LYS A 98 7.285 0.617 -4.419 1.00 0.00 H new ATOM 0 HA LYS A 98 5.450 2.603 -5.008 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.072 2.245 -7.325 1.00 0.00 H new ATOM 0 HB3 LYS A 98 7.491 2.098 -6.306 1.00 0.00 H new ATOM 0 HG2 LYS A 98 7.339 -0.369 -6.424 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.892 -0.244 -7.406 1.00 0.00 H new ATOM 0 HD2 LYS A 98 7.193 0.995 -9.144 1.00 0.00 H new ATOM 0 HD3 LYS A 98 8.638 0.834 -8.167 1.00 0.00 H new ATOM 0 HE2 LYS A 98 8.594 -0.896 -9.903 1.00 0.00 H new ATOM 0 HE3 LYS A 98 8.494 -1.630 -8.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.504 -2.481 -8.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.902 -1.017 -9.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 6.784 -2.063 -10.391 1.00 0.00 H new ATOM 588 N ARG A 99 4.289 -0.405 -5.463 1.00 0.00 N ATOM 589 CA ARG A 99 3.092 -1.169 -5.736 1.00 0.00 C ATOM 590 C ARG A 99 2.053 -0.973 -4.658 1.00 0.00 C ATOM 591 O ARG A 99 0.915 -0.638 -4.955 1.00 0.00 O ATOM 592 CB ARG A 99 3.447 -2.637 -5.883 1.00 0.00 C ATOM 593 CG ARG A 99 4.219 -2.938 -7.154 1.00 0.00 C ATOM 594 CD ARG A 99 4.790 -4.338 -7.122 1.00 0.00 C ATOM 595 NE ARG A 99 5.454 -4.699 -8.373 1.00 0.00 N ATOM 596 CZ ARG A 99 4.838 -4.761 -9.552 1.00 0.00 C ATOM 597 NH1 ARG A 99 3.540 -4.498 -9.645 1.00 0.00 N ATOM 598 NH2 ARG A 99 5.520 -5.091 -10.641 1.00 0.00 N ATOM 0 H ARG A 99 5.073 -0.957 -5.115 1.00 0.00 H new ATOM 0 HA ARG A 99 2.659 -0.811 -6.670 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.039 -2.949 -5.023 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.532 -3.229 -5.872 1.00 0.00 H new ATOM 0 HG2 ARG A 99 3.562 -2.829 -8.017 1.00 0.00 H new ATOM 0 HG3 ARG A 99 5.026 -2.215 -7.274 1.00 0.00 H new ATOM 0 HD2 ARG A 99 5.502 -4.418 -6.300 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.989 -5.049 -6.921 1.00 0.00 H new ATOM 0 HE ARG A 99 6.450 -4.917 -8.341 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.009 -4.247 -8.811 1.00 0.00 H new ATOM 0 HH12 ARG A 99 3.073 -4.547 -10.551 1.00 0.00 H new ATOM 0 HH21 ARG A 99 6.517 -5.297 -10.576 1.00 0.00 H new ATOM 0 HH22 ARG A 99 5.048 -5.138 -11.544 1.00 0.00 H new ATOM 612 N THR A 100 2.440 -1.189 -3.415 1.00 0.00 N ATOM 613 CA THR A 100 1.516 -1.048 -2.308 1.00 0.00 C ATOM 614 C THR A 100 0.941 0.352 -2.183 1.00 0.00 C ATOM 615 O THR A 100 -0.201 0.511 -1.772 1.00 0.00 O ATOM 616 CB THR A 100 2.147 -1.442 -0.979 1.00 0.00 C ATOM 617 OG1 THR A 100 3.344 -0.689 -0.759 1.00 0.00 O ATOM 618 CG2 THR A 100 2.457 -2.925 -0.940 1.00 0.00 C ATOM 0 H THR A 100 3.386 -1.462 -3.148 1.00 0.00 H new ATOM 0 HA THR A 100 0.700 -1.733 -2.539 1.00 0.00 H new ATOM 0 HB THR A 100 1.431 -1.221 -0.187 1.00 0.00 H new ATOM 0 HG1 THR A 100 4.124 -1.251 -0.952 1.00 0.00 H new ATOM 0 HG21 THR A 100 2.907 -3.178 0.020 1.00 0.00 H new ATOM 0 HG22 THR A 100 1.536 -3.493 -1.070 1.00 0.00 H new ATOM 0 HG23 THR A 100 3.152 -3.173 -1.742 1.00 0.00 H new ATOM 626 N VAL A 101 1.718 1.366 -2.524 1.00 0.00 N ATOM 627 CA VAL A 101 1.246 2.727 -2.434 1.00 0.00 C ATOM 628 C VAL A 101 0.101 2.957 -3.393 1.00 0.00 C ATOM 629 O VAL A 101 -0.941 3.491 -3.028 1.00 0.00 O ATOM 630 CB VAL A 101 2.372 3.692 -2.759 1.00 0.00 C ATOM 631 CG1 VAL A 101 3.498 3.534 -1.760 1.00 0.00 C ATOM 632 CG2 VAL A 101 2.858 3.489 -4.174 1.00 0.00 C ATOM 0 H VAL A 101 2.675 1.268 -2.864 1.00 0.00 H new ATOM 0 HA VAL A 101 0.898 2.900 -1.416 1.00 0.00 H new ATOM 0 HB VAL A 101 1.994 4.712 -2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 101 4.300 4.231 -2.003 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.126 3.743 -0.757 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.879 2.514 -1.800 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.665 4.191 -4.386 1.00 0.00 H new ATOM 0 HG22 VAL A 101 3.224 2.469 -4.290 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.036 3.661 -4.869 1.00 0.00 H new ATOM 642 N THR A 102 0.301 2.526 -4.618 1.00 0.00 N ATOM 643 CA THR A 102 -0.713 2.641 -5.633 1.00 0.00 C ATOM 644 C THR A 102 -1.817 1.645 -5.316 1.00 0.00 C ATOM 645 O THR A 102 -2.997 1.901 -5.544 1.00 0.00 O ATOM 646 CB THR A 102 -0.120 2.355 -7.016 1.00 0.00 C ATOM 647 OG1 THR A 102 0.815 3.381 -7.371 1.00 0.00 O ATOM 648 CG2 THR A 102 -1.205 2.259 -8.072 1.00 0.00 C ATOM 0 H THR A 102 1.167 2.089 -4.934 1.00 0.00 H new ATOM 0 HA THR A 102 -1.115 3.654 -5.645 1.00 0.00 H new ATOM 0 HB THR A 102 0.394 1.395 -6.969 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.191 3.189 -8.256 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.752 2.055 -9.042 1.00 0.00 H new ATOM 0 HG22 THR A 102 -1.892 1.452 -7.816 1.00 0.00 H new ATOM 0 HG23 THR A 102 -1.752 3.200 -8.118 1.00 0.00 H new ATOM 656 N GLU A 103 -1.402 0.514 -4.745 1.00 0.00 N ATOM 657 CA GLU A 103 -2.300 -0.531 -4.331 1.00 0.00 C ATOM 658 C GLU A 103 -3.247 0.015 -3.285 1.00 0.00 C ATOM 659 O GLU A 103 -4.451 -0.235 -3.319 1.00 0.00 O ATOM 660 CB GLU A 103 -1.487 -1.689 -3.752 1.00 0.00 C ATOM 661 CG GLU A 103 -0.923 -2.630 -4.789 1.00 0.00 C ATOM 662 CD GLU A 103 -1.986 -3.484 -5.455 1.00 0.00 C ATOM 663 OE1 GLU A 103 -3.175 -3.341 -5.098 1.00 0.00 O ATOM 664 OE2 GLU A 103 -1.629 -4.296 -6.333 1.00 0.00 O ATOM 0 H GLU A 103 -0.420 0.308 -4.561 1.00 0.00 H new ATOM 0 HA GLU A 103 -2.877 -0.890 -5.183 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -0.666 -1.282 -3.162 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.119 -2.256 -3.069 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -0.400 -2.051 -5.550 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -0.185 -3.280 -4.319 1.00 0.00 H new ATOM 671 N LEU A 104 -2.685 0.791 -2.363 1.00 0.00 N ATOM 672 CA LEU A 104 -3.468 1.404 -1.316 1.00 0.00 C ATOM 673 C LEU A 104 -4.191 2.600 -1.898 1.00 0.00 C ATOM 674 O LEU A 104 -5.311 2.916 -1.512 1.00 0.00 O ATOM 675 CB LEU A 104 -2.584 1.775 -0.114 1.00 0.00 C ATOM 676 CG LEU A 104 -1.485 2.795 -0.340 1.00 0.00 C ATOM 677 CD1 LEU A 104 -1.980 4.192 -0.040 1.00 0.00 C ATOM 678 CD2 LEU A 104 -0.309 2.458 0.542 1.00 0.00 C ATOM 0 H LEU A 104 -1.688 1.005 -2.327 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.209 0.701 -0.936 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.233 2.150 0.677 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.122 0.861 0.259 1.00 0.00 H new ATOM 0 HG LEU A 104 -1.179 2.764 -1.386 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.175 4.907 -0.209 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.819 4.429 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.303 4.248 1.000 1.00 0.00 H new ATOM 0 HD21 LEU A 104 0.485 3.188 0.384 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.620 2.480 1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 104 0.059 1.462 0.293 1.00 0.00 H new ATOM 690 N ASP A 105 -3.543 3.228 -2.873 1.00 0.00 N ATOM 691 CA ASP A 105 -4.114 4.363 -3.576 1.00 0.00 C ATOM 692 C ASP A 105 -5.258 3.884 -4.462 1.00 0.00 C ATOM 693 O ASP A 105 -6.062 4.675 -4.952 1.00 0.00 O ATOM 694 CB ASP A 105 -3.045 5.026 -4.442 1.00 0.00 C ATOM 695 CG ASP A 105 -3.514 6.330 -5.065 1.00 0.00 C ATOM 696 OD1 ASP A 105 -4.648 6.761 -4.765 1.00 0.00 O ATOM 697 OD2 ASP A 105 -2.744 6.924 -5.848 1.00 0.00 O ATOM 0 H ASP A 105 -2.612 2.964 -3.195 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.488 5.086 -2.851 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -2.160 5.217 -3.835 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.747 4.338 -5.233 1.00 0.00 H new ATOM 702 N SER A 106 -5.299 2.573 -4.669 1.00 0.00 N ATOM 703 CA SER A 106 -6.315 1.942 -5.501 1.00 0.00 C ATOM 704 C SER A 106 -7.523 1.547 -4.676 1.00 0.00 C ATOM 705 O SER A 106 -8.634 2.016 -4.909 1.00 0.00 O ATOM 706 CB SER A 106 -5.733 0.710 -6.198 1.00 0.00 C ATOM 707 OG SER A 106 -6.714 0.058 -6.985 1.00 0.00 O ATOM 0 H SER A 106 -4.629 1.918 -4.265 1.00 0.00 H new ATOM 0 HA SER A 106 -6.635 2.663 -6.253 1.00 0.00 H new ATOM 0 HB2 SER A 106 -4.895 1.007 -6.829 1.00 0.00 H new ATOM 0 HB3 SER A 106 -5.341 0.018 -5.453 1.00 0.00 H new ATOM 0 HG SER A 106 -6.317 -0.725 -7.421 1.00 0.00 H new ATOM 713 N VAL A 107 -7.287 0.683 -3.708 1.00 0.00 N ATOM 714 CA VAL A 107 -8.334 0.214 -2.832 1.00 0.00 C ATOM 715 C VAL A 107 -9.005 1.385 -2.150 1.00 0.00 C ATOM 716 O VAL A 107 -10.229 1.454 -2.058 1.00 0.00 O ATOM 717 CB VAL A 107 -7.755 -0.741 -1.792 1.00 0.00 C ATOM 718 CG1 VAL A 107 -8.860 -1.405 -1.007 1.00 0.00 C ATOM 719 CG2 VAL A 107 -6.878 -1.772 -2.478 1.00 0.00 C ATOM 0 H VAL A 107 -6.367 0.290 -3.510 1.00 0.00 H new ATOM 0 HA VAL A 107 -9.078 -0.319 -3.424 1.00 0.00 H new ATOM 0 HB VAL A 107 -7.144 -0.175 -1.089 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -8.427 -2.082 -0.271 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -9.452 -0.645 -0.497 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -9.500 -1.968 -1.686 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -6.466 -2.453 -1.733 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -7.473 -2.337 -3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -6.064 -1.268 -2.999 1.00 0.00 H new ATOM 729 N THR A 108 -8.187 2.314 -1.697 1.00 0.00 N ATOM 730 CA THR A 108 -8.678 3.516 -1.043 1.00 0.00 C ATOM 731 C THR A 108 -9.559 4.298 -1.981 1.00 0.00 C ATOM 732 O THR A 108 -10.499 4.983 -1.578 1.00 0.00 O ATOM 733 CB THR A 108 -7.502 4.412 -0.620 1.00 0.00 C ATOM 734 OG1 THR A 108 -7.876 5.243 0.485 1.00 0.00 O ATOM 735 CG2 THR A 108 -7.043 5.286 -1.779 1.00 0.00 C ATOM 0 H THR A 108 -7.171 2.261 -1.770 1.00 0.00 H new ATOM 0 HA THR A 108 -9.248 3.213 -0.165 1.00 0.00 H new ATOM 0 HB THR A 108 -6.680 3.763 -0.319 1.00 0.00 H new ATOM 0 HG1 THR A 108 -7.116 5.806 0.743 1.00 0.00 H new ATOM 0 HG21 THR A 108 -6.210 5.911 -1.456 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.722 4.654 -2.607 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.867 5.920 -2.105 1.00 0.00 H new ATOM 743 N ALA A 109 -9.196 4.209 -3.231 1.00 0.00 N ATOM 744 CA ALA A 109 -9.865 4.910 -4.285 1.00 0.00 C ATOM 745 C ALA A 109 -11.253 4.348 -4.587 1.00 0.00 C ATOM 746 O ALA A 109 -12.193 5.101 -4.836 1.00 0.00 O ATOM 747 CB ALA A 109 -8.961 4.857 -5.494 1.00 0.00 C ATOM 0 H ALA A 109 -8.413 3.637 -3.548 1.00 0.00 H new ATOM 0 HA ALA A 109 -10.047 5.941 -3.982 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -9.433 5.381 -6.325 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -8.010 5.334 -5.258 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -8.787 3.818 -5.773 1.00 0.00 H new ATOM 753 N ARG A 110 -11.372 3.030 -4.582 1.00 0.00 N ATOM 754 CA ARG A 110 -12.635 2.380 -4.871 1.00 0.00 C ATOM 755 C ARG A 110 -13.522 2.266 -3.638 1.00 0.00 C ATOM 756 O ARG A 110 -14.745 2.297 -3.737 1.00 0.00 O ATOM 757 CB ARG A 110 -12.398 0.995 -5.479 1.00 0.00 C ATOM 758 CG ARG A 110 -11.888 1.029 -6.913 1.00 0.00 C ATOM 759 CD ARG A 110 -10.556 1.756 -7.032 1.00 0.00 C ATOM 760 NE ARG A 110 -10.077 1.795 -8.413 1.00 0.00 N ATOM 761 CZ ARG A 110 -10.732 2.391 -9.408 1.00 0.00 C ATOM 762 NH1 ARG A 110 -11.879 3.016 -9.176 1.00 0.00 N ATOM 763 NH2 ARG A 110 -10.236 2.365 -10.638 1.00 0.00 N ATOM 0 H ARG A 110 -10.605 2.389 -4.380 1.00 0.00 H new ATOM 0 HA ARG A 110 -13.159 3.007 -5.593 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -11.680 0.456 -4.861 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -13.331 0.431 -5.449 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -11.778 0.009 -7.282 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -12.626 1.520 -7.548 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -10.663 2.774 -6.656 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -9.815 1.261 -6.405 1.00 0.00 H new ATOM 0 HE ARG A 110 -9.190 1.339 -8.627 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -12.264 3.042 -8.232 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -12.376 3.471 -9.942 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -9.353 1.889 -10.822 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -10.738 2.821 -11.400 1.00 0.00 H new ATOM 777 N LEU A 111 -12.891 2.122 -2.488 1.00 0.00 N ATOM 778 CA LEU A 111 -13.603 1.978 -1.216 1.00 0.00 C ATOM 779 C LEU A 111 -14.457 3.198 -0.889 1.00 0.00 C ATOM 780 O LEU A 111 -15.555 3.070 -0.357 1.00 0.00 O ATOM 781 CB LEU A 111 -12.598 1.724 -0.088 1.00 0.00 C ATOM 782 CG LEU A 111 -13.076 2.058 1.326 1.00 0.00 C ATOM 783 CD1 LEU A 111 -14.202 1.131 1.740 1.00 0.00 C ATOM 784 CD2 LEU A 111 -11.923 1.962 2.313 1.00 0.00 C ATOM 0 H LEU A 111 -11.875 2.101 -2.401 1.00 0.00 H new ATOM 0 HA LEU A 111 -14.278 1.128 -1.312 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -12.311 0.673 -0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -11.699 2.305 -0.292 1.00 0.00 H new ATOM 0 HG LEU A 111 -13.452 3.081 1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -14.529 1.384 2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -15.038 1.242 1.049 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -13.850 0.100 1.720 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -12.280 2.203 3.314 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.521 0.949 2.305 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -11.141 2.665 2.028 1.00 0.00 H new ATOM 796 N ARG A 112 -13.934 4.370 -1.191 1.00 0.00 N ATOM 797 CA ARG A 112 -14.615 5.621 -0.913 1.00 0.00 C ATOM 798 C ARG A 112 -15.931 5.736 -1.669 1.00 0.00 C ATOM 799 O ARG A 112 -16.865 6.395 -1.211 1.00 0.00 O ATOM 800 CB ARG A 112 -13.711 6.801 -1.268 1.00 0.00 C ATOM 801 CG ARG A 112 -13.235 6.788 -2.709 1.00 0.00 C ATOM 802 CD ARG A 112 -12.513 8.077 -3.067 1.00 0.00 C ATOM 803 NE ARG A 112 -12.055 8.085 -4.454 1.00 0.00 N ATOM 804 CZ ARG A 112 -11.390 9.096 -5.005 1.00 0.00 C ATOM 805 NH1 ARG A 112 -11.104 10.174 -4.288 1.00 0.00 N ATOM 806 NH2 ARG A 112 -11.010 9.029 -6.273 1.00 0.00 N ATOM 0 H ARG A 112 -13.024 4.483 -1.637 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.842 5.638 0.153 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -14.249 7.730 -1.080 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -12.844 6.796 -0.607 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -12.568 5.940 -2.866 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.088 6.650 -3.374 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -13.180 8.923 -2.901 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.659 8.210 -2.403 1.00 0.00 H new ATOM 0 HE ARG A 112 -12.257 7.269 -5.032 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -11.394 10.229 -3.312 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -10.594 10.948 -4.713 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -11.228 8.201 -6.828 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -10.500 9.805 -6.694 1.00 0.00 H new ATOM 820 N GLU A 113 -16.001 5.095 -2.826 1.00 0.00 N ATOM 821 CA GLU A 113 -17.188 5.126 -3.638 1.00 0.00 C ATOM 822 C GLU A 113 -18.081 3.964 -3.301 1.00 0.00 C ATOM 823 O GLU A 113 -19.307 4.063 -3.373 1.00 0.00 O ATOM 824 CB GLU A 113 -16.834 5.094 -5.118 1.00 0.00 C ATOM 825 CG GLU A 113 -18.063 5.056 -5.995 1.00 0.00 C ATOM 826 CD GLU A 113 -17.748 5.240 -7.468 1.00 0.00 C ATOM 827 OE1 GLU A 113 -16.555 5.389 -7.806 1.00 0.00 O ATOM 828 OE2 GLU A 113 -18.695 5.232 -8.282 1.00 0.00 O ATOM 0 H GLU A 113 -15.237 4.545 -3.218 1.00 0.00 H new ATOM 0 HA GLU A 113 -17.717 6.056 -3.428 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -16.238 5.972 -5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -16.215 4.221 -5.324 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -18.573 4.103 -5.855 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -18.754 5.837 -5.677 1.00 0.00 H new ATOM 835 N VAL A 114 -17.459 2.855 -2.938 1.00 0.00 N ATOM 836 CA VAL A 114 -18.214 1.674 -2.598 1.00 0.00 C ATOM 837 C VAL A 114 -19.206 2.006 -1.501 1.00 0.00 C ATOM 838 O VAL A 114 -20.416 1.856 -1.678 1.00 0.00 O ATOM 839 CB VAL A 114 -17.314 0.519 -2.154 1.00 0.00 C ATOM 840 CG1 VAL A 114 -18.159 -0.659 -1.745 1.00 0.00 C ATOM 841 CG2 VAL A 114 -16.360 0.127 -3.262 1.00 0.00 C ATOM 0 H VAL A 114 -16.446 2.753 -2.873 1.00 0.00 H new ATOM 0 HA VAL A 114 -18.741 1.348 -3.495 1.00 0.00 H new ATOM 0 HB VAL A 114 -16.723 0.845 -1.298 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -17.513 -1.478 -1.430 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -18.809 -0.371 -0.919 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -18.767 -0.981 -2.590 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -15.729 -0.696 -2.925 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -16.928 -0.186 -4.138 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -15.734 0.981 -3.522 1.00 0.00 H new ATOM 851 N GLU A 115 -18.690 2.509 -0.387 1.00 0.00 N ATOM 852 CA GLU A 115 -19.541 2.918 0.708 1.00 0.00 C ATOM 853 C GLU A 115 -20.347 4.126 0.276 1.00 0.00 C ATOM 854 O GLU A 115 -21.256 4.016 -0.547 1.00 0.00 O ATOM 855 CB GLU A 115 -18.748 3.241 1.969 1.00 0.00 C ATOM 856 CG GLU A 115 -17.351 3.735 1.683 1.00 0.00 C ATOM 857 CD GLU A 115 -16.558 4.031 2.942 1.00 0.00 C ATOM 858 OE1 GLU A 115 -16.345 3.099 3.744 1.00 0.00 O ATOM 859 OE2 GLU A 115 -16.149 5.198 3.124 1.00 0.00 O ATOM 0 H GLU A 115 -17.692 2.641 -0.224 1.00 0.00 H new ATOM 0 HA GLU A 115 -20.201 2.087 0.954 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -19.283 3.997 2.543 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -18.690 2.349 2.593 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.821 2.987 1.093 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.408 4.638 1.075 1.00 0.00 H new ATOM 866 N HIS A 116 -19.990 5.283 0.811 1.00 0.00 N ATOM 867 CA HIS A 116 -20.665 6.518 0.456 1.00 0.00 C ATOM 868 C HIS A 116 -22.166 6.364 0.663 1.00 0.00 C ATOM 869 O HIS A 116 -22.978 7.060 0.051 1.00 0.00 O ATOM 870 CB HIS A 116 -20.344 6.845 -0.999 1.00 0.00 C ATOM 871 CG HIS A 116 -20.795 8.199 -1.428 1.00 0.00 C ATOM 872 ND1 HIS A 116 -20.441 9.364 -0.782 1.00 0.00 N ATOM 873 CD2 HIS A 116 -21.585 8.559 -2.452 1.00 0.00 C ATOM 874 CE1 HIS A 116 -21.003 10.390 -1.400 1.00 0.00 C ATOM 875 NE2 HIS A 116 -21.702 9.926 -2.420 1.00 0.00 N ATOM 0 H HIS A 116 -19.238 5.391 1.491 1.00 0.00 H new ATOM 0 HA HIS A 116 -20.322 7.335 1.091 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -19.267 6.767 -1.150 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -20.811 6.097 -1.640 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -22.044 7.895 -3.169 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -20.907 11.428 -1.119 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -22.241 10.491 -3.076 1.00 0.00 H new ATOM 884 N ARG A 117 -22.510 5.425 1.535 1.00 0.00 N ATOM 885 CA ARG A 117 -23.892 5.118 1.861 1.00 0.00 C ATOM 886 C ARG A 117 -23.923 3.948 2.839 1.00 0.00 C ATOM 887 O ARG A 117 -24.850 3.805 3.635 1.00 0.00 O ATOM 888 CB ARG A 117 -24.674 4.770 0.591 1.00 0.00 C ATOM 889 CG ARG A 117 -24.200 3.493 -0.080 1.00 0.00 C ATOM 890 CD ARG A 117 -24.987 3.208 -1.347 1.00 0.00 C ATOM 891 NE ARG A 117 -26.406 2.998 -1.076 1.00 0.00 N ATOM 892 CZ ARG A 117 -27.306 2.728 -2.017 1.00 0.00 C ATOM 893 NH1 ARG A 117 -26.935 2.636 -3.287 1.00 0.00 N ATOM 894 NH2 ARG A 117 -28.578 2.548 -1.688 1.00 0.00 N ATOM 0 H ARG A 117 -21.832 4.853 2.038 1.00 0.00 H new ATOM 0 HA ARG A 117 -24.360 5.989 2.320 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -25.730 4.670 0.840 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -24.590 5.595 -0.116 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -23.140 3.578 -0.320 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -24.305 2.657 0.611 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -24.870 4.040 -2.041 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -24.577 2.325 -1.837 1.00 0.00 H new ATOM 0 HE ARG A 117 -26.725 3.062 -0.109 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -25.957 2.772 -3.544 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -27.627 2.429 -4.007 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -28.867 2.617 -0.712 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -29.267 2.341 -2.411 1.00 0.00 H new ATOM 908 N ALA A 118 -22.882 3.118 2.760 1.00 0.00 N ATOM 909 CA ALA A 118 -22.745 1.950 3.623 1.00 0.00 C ATOM 910 C ALA A 118 -23.924 0.993 3.442 1.00 0.00 C ATOM 911 O ALA A 118 -24.340 0.719 2.316 1.00 0.00 O ATOM 912 CB ALA A 118 -22.612 2.382 5.076 1.00 0.00 C ATOM 0 H ALA A 118 -22.115 3.238 2.098 1.00 0.00 H new ATOM 0 HA ALA A 118 -21.839 1.415 3.338 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -22.510 1.501 5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -21.731 3.014 5.189 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -23.499 2.941 5.372 1.00 0.00 H new ATOM 918 N GLY A 119 -24.463 0.490 4.553 1.00 0.00 N ATOM 919 CA GLY A 119 -25.589 -0.425 4.481 1.00 0.00 C ATOM 920 C GLY A 119 -26.066 -0.871 5.850 1.00 0.00 C ATOM 921 O GLY A 119 -27.266 -0.864 6.128 1.00 0.00 O ATOM 0 H GLY A 119 -24.140 0.700 5.498 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -26.411 0.058 3.953 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -25.305 -1.300 3.896 1.00 0.00 H new ATOM 925 N GLU A 120 -25.125 -1.259 6.707 1.00 0.00 N ATOM 926 CA GLU A 120 -25.452 -1.713 8.055 1.00 0.00 C ATOM 927 C GLU A 120 -24.184 -1.958 8.867 1.00 0.00 C ATOM 928 O GLU A 120 -23.984 -1.255 9.880 1.00 0.00 O ATOM 929 CB GLU A 120 -26.290 -2.993 8.000 1.00 0.00 C ATOM 930 CG GLU A 120 -26.645 -3.550 9.370 1.00 0.00 C ATOM 931 CD GLU A 120 -27.485 -4.810 9.288 1.00 0.00 C ATOM 932 OE1 GLU A 120 -28.617 -4.736 8.766 1.00 0.00 O ATOM 933 OE2 GLU A 120 -27.010 -5.871 9.742 1.00 0.00 O ATOM 934 OXT GLU A 120 -23.400 -2.852 8.483 1.00 0.00 O ATOM 0 H GLU A 120 -24.128 -1.268 6.491 1.00 0.00 H new ATOM 0 HA GLU A 120 -26.032 -0.930 8.543 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -27.209 -2.792 7.450 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -25.743 -3.751 7.440 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -25.728 -3.764 9.920 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -27.187 -2.793 9.937 1.00 0.00 H new TER 941 GLU A 120 ATOM 942 N ALA B 61 11.148 6.913 -13.317 1.00 0.00 N ATOM 943 CA ALA B 61 10.299 7.873 -12.566 1.00 0.00 C ATOM 944 C ALA B 61 10.816 8.064 -11.145 1.00 0.00 C ATOM 945 O ALA B 61 11.176 7.099 -10.470 1.00 0.00 O ATOM 946 CB ALA B 61 8.856 7.392 -12.539 1.00 0.00 C ATOM 0 HA ALA B 61 10.342 8.835 -13.077 1.00 0.00 H new ATOM 0 HB1 ALA B 61 8.245 8.105 -11.985 1.00 0.00 H new ATOM 0 HB2 ALA B 61 8.481 7.308 -13.559 1.00 0.00 H new ATOM 0 HB3 ALA B 61 8.806 6.418 -12.053 1.00 0.00 H new ATOM 954 N SER B 62 10.851 9.315 -10.696 1.00 0.00 N ATOM 955 CA SER B 62 11.324 9.633 -9.354 1.00 0.00 C ATOM 956 C SER B 62 10.470 8.939 -8.299 1.00 0.00 C ATOM 957 O SER B 62 9.240 8.966 -8.363 1.00 0.00 O ATOM 958 CB SER B 62 11.303 11.145 -9.127 1.00 0.00 C ATOM 959 OG SER B 62 12.132 11.815 -10.060 1.00 0.00 O ATOM 0 H SER B 62 10.557 10.125 -11.242 1.00 0.00 H new ATOM 0 HA SER B 62 12.349 9.273 -9.263 1.00 0.00 H new ATOM 0 HB2 SER B 62 10.281 11.514 -9.214 1.00 0.00 H new ATOM 0 HB3 SER B 62 11.637 11.368 -8.114 1.00 0.00 H new ATOM 0 HG SER B 62 12.099 12.780 -9.893 1.00 0.00 H new ATOM 965 N ASP B 63 11.131 8.320 -7.328 1.00 0.00 N ATOM 966 CA ASP B 63 10.437 7.621 -6.255 1.00 0.00 C ATOM 967 C ASP B 63 9.620 8.596 -5.414 1.00 0.00 C ATOM 968 O ASP B 63 8.526 8.268 -4.955 1.00 0.00 O ATOM 969 CB ASP B 63 11.439 6.876 -5.371 1.00 0.00 C ATOM 970 CG ASP B 63 12.226 5.830 -6.138 1.00 0.00 C ATOM 971 OD1 ASP B 63 11.992 5.684 -7.357 1.00 0.00 O ATOM 972 OD2 ASP B 63 13.076 5.157 -5.519 1.00 0.00 O ATOM 0 H ASP B 63 12.148 8.288 -7.262 1.00 0.00 H new ATOM 0 HA ASP B 63 9.756 6.898 -6.704 1.00 0.00 H new ATOM 0 HB2 ASP B 63 12.130 7.593 -4.927 1.00 0.00 H new ATOM 0 HB3 ASP B 63 10.907 6.396 -4.550 1.00 0.00 H new ATOM 977 N ASP B 64 10.164 9.796 -5.217 1.00 0.00 N ATOM 978 CA ASP B 64 9.493 10.826 -4.429 1.00 0.00 C ATOM 979 C ASP B 64 8.055 11.023 -4.895 1.00 0.00 C ATOM 980 O ASP B 64 7.150 11.184 -4.078 1.00 0.00 O ATOM 981 CB ASP B 64 10.255 12.149 -4.524 1.00 0.00 C ATOM 982 CG ASP B 64 11.683 12.031 -4.031 1.00 0.00 C ATOM 983 OD1 ASP B 64 11.875 11.680 -2.849 1.00 0.00 O ATOM 984 OD2 ASP B 64 12.609 12.289 -4.829 1.00 0.00 O ATOM 0 H ASP B 64 11.069 10.078 -5.593 1.00 0.00 H new ATOM 0 HA ASP B 64 9.477 10.496 -3.390 1.00 0.00 H new ATOM 0 HB2 ASP B 64 10.258 12.490 -5.559 1.00 0.00 H new ATOM 0 HB3 ASP B 64 9.734 12.908 -3.940 1.00 0.00 H new ATOM 989 N GLU B 65 7.852 11.006 -6.208 1.00 0.00 N ATOM 990 CA GLU B 65 6.519 11.178 -6.773 1.00 0.00 C ATOM 991 C GLU B 65 5.569 10.127 -6.213 1.00 0.00 C ATOM 992 O GLU B 65 4.427 10.428 -5.865 1.00 0.00 O ATOM 993 CB GLU B 65 6.564 11.078 -8.299 1.00 0.00 C ATOM 994 CG GLU B 65 5.214 11.298 -8.965 1.00 0.00 C ATOM 995 CD GLU B 65 5.274 11.164 -10.474 1.00 0.00 C ATOM 996 OE1 GLU B 65 6.360 10.843 -11.000 1.00 0.00 O ATOM 997 OE2 GLU B 65 4.233 11.377 -11.130 1.00 0.00 O ATOM 0 H GLU B 65 8.591 10.875 -6.899 1.00 0.00 H new ATOM 0 HA GLU B 65 6.156 12.168 -6.498 1.00 0.00 H new ATOM 0 HB2 GLU B 65 7.272 11.813 -8.682 1.00 0.00 H new ATOM 0 HB3 GLU B 65 6.942 10.095 -8.579 1.00 0.00 H new ATOM 0 HG2 GLU B 65 4.497 10.578 -8.569 1.00 0.00 H new ATOM 0 HG3 GLU B 65 4.844 12.291 -8.707 1.00 0.00 H new ATOM 1004 N LEU B 66 6.056 8.894 -6.122 1.00 0.00 N ATOM 1005 CA LEU B 66 5.258 7.796 -5.598 1.00 0.00 C ATOM 1006 C LEU B 66 4.968 8.013 -4.119 1.00 0.00 C ATOM 1007 O LEU B 66 3.823 7.914 -3.679 1.00 0.00 O ATOM 1008 CB LEU B 66 5.991 6.466 -5.794 1.00 0.00 C ATOM 1009 CG LEU B 66 6.587 6.249 -7.187 1.00 0.00 C ATOM 1010 CD1 LEU B 66 7.191 4.859 -7.296 1.00 0.00 C ATOM 1011 CD2 LEU B 66 5.537 6.466 -8.267 1.00 0.00 C ATOM 0 H LEU B 66 7.000 8.632 -6.405 1.00 0.00 H new ATOM 0 HA LEU B 66 4.314 7.764 -6.143 1.00 0.00 H new ATOM 0 HB2 LEU B 66 6.793 6.400 -5.059 1.00 0.00 H new ATOM 0 HB3 LEU B 66 5.297 5.653 -5.583 1.00 0.00 H new ATOM 0 HG LEU B 66 7.380 6.982 -7.337 1.00 0.00 H new ATOM 0 HD11 LEU B 66 7.610 4.722 -8.293 1.00 0.00 H new ATOM 0 HD12 LEU B 66 7.979 4.746 -6.552 1.00 0.00 H new ATOM 0 HD13 LEU B 66 6.417 4.111 -7.122 1.00 0.00 H new ATOM 0 HD21 LEU B 66 5.985 6.306 -9.248 1.00 0.00 H new ATOM 0 HD22 LEU B 66 4.717 5.762 -8.124 1.00 0.00 H new ATOM 0 HD23 LEU B 66 5.156 7.485 -8.204 1.00 0.00 H new ATOM 1023 N PHE B 67 6.018 8.318 -3.359 1.00 0.00 N ATOM 1024 CA PHE B 67 5.889 8.558 -1.927 1.00 0.00 C ATOM 1025 C PHE B 67 4.931 9.712 -1.651 1.00 0.00 C ATOM 1026 O PHE B 67 4.234 9.725 -0.636 1.00 0.00 O ATOM 1027 CB PHE B 67 7.257 8.849 -1.305 1.00 0.00 C ATOM 1028 CG PHE B 67 8.231 7.711 -1.428 1.00 0.00 C ATOM 1029 CD1 PHE B 67 7.961 6.488 -0.839 1.00 0.00 C ATOM 1030 CD2 PHE B 67 9.420 7.866 -2.121 1.00 0.00 C ATOM 1031 CE1 PHE B 67 8.855 5.441 -0.940 1.00 0.00 C ATOM 1032 CE2 PHE B 67 10.318 6.821 -2.228 1.00 0.00 C ATOM 1033 CZ PHE B 67 10.034 5.606 -1.636 1.00 0.00 C ATOM 0 H PHE B 67 6.970 8.404 -3.715 1.00 0.00 H new ATOM 0 HA PHE B 67 5.481 7.656 -1.471 1.00 0.00 H new ATOM 0 HB2 PHE B 67 7.682 9.733 -1.781 1.00 0.00 H new ATOM 0 HB3 PHE B 67 7.123 9.089 -0.250 1.00 0.00 H new ATOM 0 HD1 PHE B 67 7.039 6.351 -0.293 1.00 0.00 H new ATOM 0 HD2 PHE B 67 9.648 8.815 -2.583 1.00 0.00 H new ATOM 0 HE1 PHE B 67 8.631 4.493 -0.474 1.00 0.00 H new ATOM 0 HE2 PHE B 67 11.240 6.954 -2.774 1.00 0.00 H new ATOM 0 HZ PHE B 67 10.733 4.787 -1.718 1.00 0.00 H new ATOM 1043 N SER B 68 4.904 10.679 -2.563 1.00 0.00 N ATOM 1044 CA SER B 68 4.033 11.841 -2.424 1.00 0.00 C ATOM 1045 C SER B 68 2.578 11.412 -2.275 1.00 0.00 C ATOM 1046 O SER B 68 1.831 11.983 -1.481 1.00 0.00 O ATOM 1047 CB SER B 68 4.184 12.766 -3.633 1.00 0.00 C ATOM 1048 OG SER B 68 3.348 13.903 -3.512 1.00 0.00 O ATOM 0 H SER B 68 5.476 10.681 -3.407 1.00 0.00 H new ATOM 0 HA SER B 68 4.328 12.381 -1.525 1.00 0.00 H new ATOM 0 HB2 SER B 68 5.223 13.083 -3.725 1.00 0.00 H new ATOM 0 HB3 SER B 68 3.934 12.222 -4.544 1.00 0.00 H new ATOM 0 HG SER B 68 3.464 14.479 -4.296 1.00 0.00 H new ATOM 1054 N MET B 69 2.183 10.397 -3.043 1.00 0.00 N ATOM 1055 CA MET B 69 0.818 9.889 -2.991 1.00 0.00 C ATOM 1056 C MET B 69 0.453 9.498 -1.565 1.00 0.00 C ATOM 1057 O MET B 69 -0.641 9.796 -1.087 1.00 0.00 O ATOM 1058 CB MET B 69 0.661 8.679 -3.919 1.00 0.00 C ATOM 1059 CG MET B 69 1.115 8.943 -5.343 1.00 0.00 C ATOM 1060 SD MET B 69 0.918 7.505 -6.412 1.00 0.00 S ATOM 1061 CE MET B 69 2.009 6.334 -5.610 1.00 0.00 C ATOM 0 H MET B 69 2.789 9.913 -3.706 1.00 0.00 H new ATOM 0 HA MET B 69 0.145 10.679 -3.325 1.00 0.00 H new ATOM 0 HB2 MET B 69 1.232 7.844 -3.513 1.00 0.00 H new ATOM 0 HB3 MET B 69 -0.385 8.374 -3.931 1.00 0.00 H new ATOM 0 HG2 MET B 69 0.545 9.777 -5.753 1.00 0.00 H new ATOM 0 HG3 MET B 69 2.162 9.245 -5.336 1.00 0.00 H new ATOM 0 HE1 MET B 69 2.512 5.730 -6.365 1.00 0.00 H new ATOM 0 HE2 MET B 69 2.752 6.873 -5.022 1.00 0.00 H new ATOM 0 HE3 MET B 69 1.428 5.685 -4.954 1.00 0.00 H new ATOM 1071 N LEU B 70 1.384 8.830 -0.889 1.00 0.00 N ATOM 1072 CA LEU B 70 1.166 8.397 0.486 1.00 0.00 C ATOM 1073 C LEU B 70 1.057 9.593 1.420 1.00 0.00 C ATOM 1074 O LEU B 70 0.297 9.569 2.380 1.00 0.00 O ATOM 1075 CB LEU B 70 2.295 7.478 0.962 1.00 0.00 C ATOM 1076 CG LEU B 70 2.554 6.243 0.096 1.00 0.00 C ATOM 1077 CD1 LEU B 70 1.247 5.560 -0.279 1.00 0.00 C ATOM 1078 CD2 LEU B 70 3.334 6.622 -1.150 1.00 0.00 C ATOM 0 H LEU B 70 2.295 8.578 -1.271 1.00 0.00 H new ATOM 0 HA LEU B 70 0.229 7.841 0.507 1.00 0.00 H new ATOM 0 HB2 LEU B 70 3.215 8.061 1.016 1.00 0.00 H new ATOM 0 HB3 LEU B 70 2.067 7.147 1.975 1.00 0.00 H new ATOM 0 HG LEU B 70 3.150 5.539 0.677 1.00 0.00 H new ATOM 0 HD11 LEU B 70 1.457 4.685 -0.894 1.00 0.00 H new ATOM 0 HD12 LEU B 70 0.726 5.250 0.627 1.00 0.00 H new ATOM 0 HD13 LEU B 70 0.621 6.255 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU B 70 3.509 5.732 -1.754 1.00 0.00 H new ATOM 0 HD22 LEU B 70 2.763 7.348 -1.730 1.00 0.00 H new ATOM 0 HD23 LEU B 70 4.290 7.059 -0.862 1.00 0.00 H new ATOM 1090 N ASP B 71 1.828 10.634 1.139 1.00 0.00 N ATOM 1091 CA ASP B 71 1.815 11.833 1.967 1.00 0.00 C ATOM 1092 C ASP B 71 0.391 12.357 2.146 1.00 0.00 C ATOM 1093 O ASP B 71 0.028 12.837 3.220 1.00 0.00 O ATOM 1094 CB ASP B 71 2.698 12.915 1.345 1.00 0.00 C ATOM 1095 CG ASP B 71 2.762 14.169 2.195 1.00 0.00 C ATOM 1096 OD1 ASP B 71 3.208 14.074 3.359 1.00 0.00 O ATOM 1097 OD2 ASP B 71 2.368 15.244 1.699 1.00 0.00 O ATOM 0 H ASP B 71 2.469 10.673 0.346 1.00 0.00 H new ATOM 0 HA ASP B 71 2.210 11.572 2.949 1.00 0.00 H new ATOM 0 HB2 ASP B 71 3.705 12.522 1.206 1.00 0.00 H new ATOM 0 HB3 ASP B 71 2.315 13.169 0.357 1.00 0.00 H new ATOM 1102 N GLN B 72 -0.407 12.269 1.085 1.00 0.00 N ATOM 1103 CA GLN B 72 -1.788 12.742 1.122 1.00 0.00 C ATOM 1104 C GLN B 72 -2.713 11.748 1.828 1.00 0.00 C ATOM 1105 O GLN B 72 -3.451 12.118 2.741 1.00 0.00 O ATOM 1106 CB GLN B 72 -2.289 13.003 -0.300 1.00 0.00 C ATOM 1107 CG GLN B 72 -3.693 13.581 -0.357 1.00 0.00 C ATOM 1108 CD GLN B 72 -4.146 13.873 -1.774 1.00 0.00 C ATOM 1109 OE1 GLN B 72 -4.232 12.973 -2.609 1.00 0.00 O ATOM 1110 NE2 GLN B 72 -4.436 15.138 -2.054 1.00 0.00 N ATOM 0 H GLN B 72 -0.121 11.874 0.189 1.00 0.00 H new ATOM 0 HA GLN B 72 -1.804 13.671 1.693 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -1.603 13.689 -0.797 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -2.267 12.068 -0.861 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -4.389 12.882 0.106 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -3.728 14.500 0.228 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -4.351 15.853 -1.331 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -4.744 15.395 -2.992 1.00 0.00 H new ATOM 1119 N ARG B 73 -2.674 10.487 1.398 1.00 0.00 N ATOM 1120 CA ARG B 73 -3.518 9.447 1.988 1.00 0.00 C ATOM 1121 C ARG B 73 -3.191 9.228 3.463 1.00 0.00 C ATOM 1122 O ARG B 73 -4.085 9.138 4.303 1.00 0.00 O ATOM 1123 CB ARG B 73 -3.357 8.125 1.227 1.00 0.00 C ATOM 1124 CG ARG B 73 -4.076 8.086 -0.114 1.00 0.00 C ATOM 1125 CD ARG B 73 -3.531 9.121 -1.086 1.00 0.00 C ATOM 1126 NE ARG B 73 -4.226 9.084 -2.370 1.00 0.00 N ATOM 1127 CZ ARG B 73 -5.525 9.334 -2.517 1.00 0.00 C ATOM 1128 NH1 ARG B 73 -6.266 9.658 -1.464 1.00 0.00 N ATOM 1129 NH2 ARG B 73 -6.083 9.267 -3.717 1.00 0.00 N ATOM 0 H ARG B 73 -2.068 10.161 0.645 1.00 0.00 H new ATOM 0 HA ARG B 73 -4.551 9.787 1.911 1.00 0.00 H new ATOM 0 HB2 ARG B 73 -2.295 7.940 1.063 1.00 0.00 H new ATOM 0 HB3 ARG B 73 -3.730 7.312 1.850 1.00 0.00 H new ATOM 0 HG2 ARG B 73 -3.976 7.092 -0.550 1.00 0.00 H new ATOM 0 HG3 ARG B 73 -5.141 8.260 0.041 1.00 0.00 H new ATOM 0 HD2 ARG B 73 -3.628 10.115 -0.650 1.00 0.00 H new ATOM 0 HD3 ARG B 73 -2.467 8.945 -1.244 1.00 0.00 H new ATOM 0 HE ARG B 73 -3.684 8.853 -3.203 1.00 0.00 H new ATOM 0 HH11 ARG B 73 -5.840 9.716 -0.539 1.00 0.00 H new ATOM 0 HH12 ARG B 73 -7.261 9.849 -1.580 1.00 0.00 H new ATOM 0 HH21 ARG B 73 -5.517 9.024 -4.530 1.00 0.00 H new ATOM 0 HH22 ARG B 73 -7.079 9.459 -3.828 1.00 0.00 H new ATOM 1143 N PHE B 74 -1.904 9.129 3.761 1.00 0.00 N ATOM 1144 CA PHE B 74 -1.440 8.905 5.126 1.00 0.00 C ATOM 1145 C PHE B 74 -1.657 10.150 5.979 1.00 0.00 C ATOM 1146 O PHE B 74 -1.692 10.075 7.208 1.00 0.00 O ATOM 1147 CB PHE B 74 0.046 8.520 5.120 1.00 0.00 C ATOM 1148 CG PHE B 74 0.358 7.243 4.374 1.00 0.00 C ATOM 1149 CD1 PHE B 74 -0.563 6.676 3.502 1.00 0.00 C ATOM 1150 CD2 PHE B 74 1.579 6.608 4.547 1.00 0.00 C ATOM 1151 CE1 PHE B 74 -0.274 5.510 2.821 1.00 0.00 C ATOM 1152 CE2 PHE B 74 1.874 5.440 3.865 1.00 0.00 C ATOM 1153 CZ PHE B 74 0.945 4.891 3.001 1.00 0.00 C ATOM 0 H PHE B 74 -1.156 9.201 3.071 1.00 0.00 H new ATOM 0 HA PHE B 74 -2.017 8.087 5.558 1.00 0.00 H new ATOM 0 HB2 PHE B 74 0.618 9.335 4.676 1.00 0.00 H new ATOM 0 HB3 PHE B 74 0.386 8.417 6.150 1.00 0.00 H new ATOM 0 HD1 PHE B 74 -1.520 7.155 3.354 1.00 0.00 H new ATOM 0 HD2 PHE B 74 2.309 7.030 5.222 1.00 0.00 H new ATOM 0 HE1 PHE B 74 -1.002 5.083 2.148 1.00 0.00 H new ATOM 0 HE2 PHE B 74 2.830 4.958 4.008 1.00 0.00 H new ATOM 0 HZ PHE B 74 1.173 3.980 2.468 1.00 0.00 H new ATOM 1163 N GLY B 75 -1.811 11.293 5.317 1.00 0.00 N ATOM 1164 CA GLY B 75 -2.033 12.539 6.027 1.00 0.00 C ATOM 1165 C GLY B 75 -3.343 12.540 6.790 1.00 0.00 C ATOM 1166 O GLY B 75 -3.400 12.982 7.937 1.00 0.00 O ATOM 0 H GLY B 75 -1.786 11.378 4.301 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -1.210 12.711 6.721 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -2.028 13.366 5.316 1.00 0.00 H new ATOM 1170 N GLY B 76 -4.396 12.039 6.149 1.00 0.00 N ATOM 1171 CA GLY B 76 -5.702 11.988 6.783 1.00 0.00 C ATOM 1172 C GLY B 76 -6.415 13.327 6.767 1.00 0.00 C ATOM 1173 O GLY B 76 -7.595 13.401 6.423 1.00 0.00 O ATOM 0 H GLY B 76 -4.367 11.667 5.200 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -6.319 11.247 6.275 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -5.588 11.655 7.814 1.00 0.00 H new ATOM 1177 N GLY B 77 -5.702 14.385 7.139 1.00 0.00 N ATOM 1178 CA GLY B 77 -6.296 15.709 7.156 1.00 0.00 C ATOM 1179 C GLY B 77 -5.335 16.773 7.648 1.00 0.00 C ATOM 1180 O GLY B 77 -5.725 17.666 8.401 1.00 0.00 O ATOM 0 H GLY B 77 -4.725 14.349 7.429 1.00 0.00 H new ATOM 0 HA2 GLY B 77 -6.632 15.965 6.151 1.00 0.00 H new ATOM 0 HA3 GLY B 77 -7.179 15.699 7.795 1.00 0.00 H new ATOM 1184 N GLU B 78 -4.078 16.678 7.217 1.00 0.00 N ATOM 1185 CA GLU B 78 -3.048 17.639 7.610 1.00 0.00 C ATOM 1186 C GLU B 78 -2.803 17.611 9.116 1.00 0.00 C ATOM 1187 O GLU B 78 -3.737 17.487 9.909 1.00 0.00 O ATOM 1188 CB GLU B 78 -3.433 19.056 7.173 1.00 0.00 C ATOM 1189 CG GLU B 78 -3.552 19.228 5.666 1.00 0.00 C ATOM 1190 CD GLU B 78 -4.706 18.442 5.071 1.00 0.00 C ATOM 1191 OE1 GLU B 78 -5.864 18.702 5.461 1.00 0.00 O ATOM 1192 OE2 GLU B 78 -4.450 17.567 4.217 1.00 0.00 O ATOM 0 H GLU B 78 -3.747 15.942 6.593 1.00 0.00 H new ATOM 0 HA GLU B 78 -2.125 17.349 7.107 1.00 0.00 H new ATOM 0 HB2 GLU B 78 -4.384 19.322 7.635 1.00 0.00 H new ATOM 0 HB3 GLU B 78 -2.688 19.757 7.551 1.00 0.00 H new ATOM 0 HG2 GLU B 78 -3.682 20.285 5.435 1.00 0.00 H new ATOM 0 HG3 GLU B 78 -2.622 18.911 5.195 1.00 0.00 H new ATOM 1199 N ASP B 79 -1.537 17.733 9.505 1.00 0.00 N ATOM 1200 CA ASP B 79 -1.164 17.729 10.917 1.00 0.00 C ATOM 1201 C ASP B 79 0.307 18.089 11.094 1.00 0.00 C ATOM 1202 O ASP B 79 0.644 18.999 11.853 1.00 0.00 O ATOM 1203 CB ASP B 79 -1.446 16.361 11.539 1.00 0.00 C ATOM 1204 CG ASP B 79 -1.085 16.308 13.010 1.00 0.00 C ATOM 1205 OD1 ASP B 79 -1.618 17.132 13.782 1.00 0.00 O ATOM 1206 OD2 ASP B 79 -0.272 15.440 13.391 1.00 0.00 O ATOM 0 H ASP B 79 -0.752 17.836 8.862 1.00 0.00 H new ATOM 0 HA ASP B 79 -1.766 18.481 11.426 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -2.502 16.121 11.418 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -0.883 15.598 11.002 1.00 0.00 H new ATOM 1211 N LEU B 80 1.182 17.376 10.387 1.00 0.00 N ATOM 1212 CA LEU B 80 2.615 17.635 10.470 1.00 0.00 C ATOM 1213 C LEU B 80 2.963 18.974 9.830 1.00 0.00 C ATOM 1214 O LEU B 80 2.437 19.321 8.772 1.00 0.00 O ATOM 1215 CB LEU B 80 3.421 16.520 9.791 1.00 0.00 C ATOM 1216 CG LEU B 80 3.331 15.132 10.441 1.00 0.00 C ATOM 1217 CD1 LEU B 80 3.598 15.220 11.937 1.00 0.00 C ATOM 1218 CD2 LEU B 80 1.979 14.495 10.174 1.00 0.00 C ATOM 0 H LEU B 80 0.924 16.619 9.754 1.00 0.00 H new ATOM 0 HA LEU B 80 2.878 17.665 11.527 1.00 0.00 H new ATOM 0 HB2 LEU B 80 3.088 16.437 8.756 1.00 0.00 H new ATOM 0 HB3 LEU B 80 4.469 16.820 9.766 1.00 0.00 H new ATOM 0 HG LEU B 80 4.097 14.499 9.993 1.00 0.00 H new ATOM 0 HD11 LEU B 80 3.529 14.226 12.378 1.00 0.00 H new ATOM 0 HD12 LEU B 80 4.597 15.623 12.105 1.00 0.00 H new ATOM 0 HD13 LEU B 80 2.860 15.874 12.401 1.00 0.00 H new ATOM 0 HD21 LEU B 80 1.940 13.513 10.645 1.00 0.00 H new ATOM 0 HD22 LEU B 80 1.192 15.126 10.586 1.00 0.00 H new ATOM 0 HD23 LEU B 80 1.833 14.388 9.099 1.00 0.00 H new ATOM 1230 N LEU B 81 3.857 19.719 10.472 1.00 0.00 N ATOM 1231 CA LEU B 81 4.281 21.016 9.959 1.00 0.00 C ATOM 1232 C LEU B 81 4.938 20.861 8.591 1.00 0.00 C ATOM 1233 O LEU B 81 4.735 21.683 7.696 1.00 0.00 O ATOM 1234 CB LEU B 81 5.250 21.697 10.932 1.00 0.00 C ATOM 1235 CG LEU B 81 4.644 22.144 12.270 1.00 0.00 C ATOM 1236 CD1 LEU B 81 3.471 23.087 12.039 1.00 0.00 C ATOM 1237 CD2 LEU B 81 4.212 20.944 13.100 1.00 0.00 C ATOM 0 H LEU B 81 4.302 19.446 11.349 1.00 0.00 H new ATOM 0 HA LEU B 81 3.396 21.643 9.856 1.00 0.00 H new ATOM 0 HB2 LEU B 81 6.072 21.011 11.137 1.00 0.00 H new ATOM 0 HB3 LEU B 81 5.678 22.569 10.439 1.00 0.00 H new ATOM 0 HG LEU B 81 5.412 22.680 12.827 1.00 0.00 H new ATOM 0 HD11 LEU B 81 3.055 23.393 12.999 1.00 0.00 H new ATOM 0 HD12 LEU B 81 3.814 23.967 11.495 1.00 0.00 H new ATOM 0 HD13 LEU B 81 2.703 22.577 11.457 1.00 0.00 H new ATOM 0 HD21 LEU B 81 3.786 21.288 14.043 1.00 0.00 H new ATOM 0 HD22 LEU B 81 3.464 20.372 12.551 1.00 0.00 H new ATOM 0 HD23 LEU B 81 5.076 20.311 13.302 1.00 0.00 H new ATOM 1249 N MET B 82 5.722 19.797 8.438 1.00 0.00 N ATOM 1250 CA MET B 82 6.410 19.523 7.180 1.00 0.00 C ATOM 1251 C MET B 82 7.037 18.131 7.198 1.00 0.00 C ATOM 1252 O MET B 82 6.875 17.360 6.252 1.00 0.00 O ATOM 1253 CB MET B 82 7.477 20.589 6.915 1.00 0.00 C ATOM 1254 CG MET B 82 8.282 20.349 5.648 1.00 0.00 C ATOM 1255 SD MET B 82 9.254 21.787 5.156 1.00 0.00 S ATOM 1256 CE MET B 82 10.114 22.165 6.680 1.00 0.00 C ATOM 0 H MET B 82 5.897 19.110 9.171 1.00 0.00 H new ATOM 0 HA MET B 82 5.678 19.555 6.373 1.00 0.00 H new ATOM 0 HB2 MET B 82 6.995 21.564 6.849 1.00 0.00 H new ATOM 0 HB3 MET B 82 8.158 20.628 7.765 1.00 0.00 H new ATOM 0 HG2 MET B 82 8.949 19.501 5.802 1.00 0.00 H new ATOM 0 HG3 MET B 82 7.604 20.079 4.838 1.00 0.00 H new ATOM 0 HE1 MET B 82 10.939 22.847 6.473 1.00 0.00 H new ATOM 0 HE2 MET B 82 9.423 22.633 7.381 1.00 0.00 H new ATOM 0 HE3 MET B 82 10.504 21.245 7.115 1.00 0.00 H new ATOM 1266 N SER B 83 7.737 17.813 8.286 1.00 0.00 N ATOM 1267 CA SER B 83 8.378 16.506 8.441 1.00 0.00 C ATOM 1268 C SER B 83 9.446 16.267 7.375 1.00 0.00 C ATOM 1269 O SER B 83 9.297 16.677 6.224 1.00 0.00 O ATOM 1270 CB SER B 83 7.332 15.389 8.387 1.00 0.00 C ATOM 1271 OG SER B 83 6.370 15.539 9.418 1.00 0.00 O ATOM 0 H SER B 83 7.875 18.444 9.076 1.00 0.00 H new ATOM 0 HA SER B 83 8.868 16.498 9.415 1.00 0.00 H new ATOM 0 HB2 SER B 83 6.835 15.399 7.417 1.00 0.00 H new ATOM 0 HB3 SER B 83 7.824 14.421 8.483 1.00 0.00 H new ATOM 0 HG SER B 83 6.267 14.689 9.896 1.00 0.00 H new ATOM 1277 N GLY B 84 10.523 15.595 7.770 1.00 0.00 N ATOM 1278 CA GLY B 84 11.601 15.302 6.842 1.00 0.00 C ATOM 1279 C GLY B 84 12.667 14.413 7.455 1.00 0.00 C ATOM 1280 O GLY B 84 13.210 14.725 8.515 1.00 0.00 O ATOM 0 H GLY B 84 10.669 15.247 8.718 1.00 0.00 H new ATOM 0 HA2 GLY B 84 11.192 14.816 5.956 1.00 0.00 H new ATOM 0 HA3 GLY B 84 12.056 16.236 6.512 1.00 0.00 H new ATOM 1284 N ASP B 85 12.967 13.302 6.783 1.00 0.00 N ATOM 1285 CA ASP B 85 13.973 12.357 7.263 1.00 0.00 C ATOM 1286 C ASP B 85 14.909 11.936 6.133 1.00 0.00 C ATOM 1287 O ASP B 85 15.116 10.746 5.899 1.00 0.00 O ATOM 1288 CB ASP B 85 13.303 11.113 7.861 1.00 0.00 C ATOM 1289 CG ASP B 85 12.499 11.408 9.114 1.00 0.00 C ATOM 1290 OD1 ASP B 85 12.459 12.579 9.537 1.00 0.00 O ATOM 1291 OD2 ASP B 85 11.910 10.461 9.675 1.00 0.00 O ATOM 0 H ASP B 85 12.526 13.035 5.903 1.00 0.00 H new ATOM 0 HA ASP B 85 14.556 12.858 8.036 1.00 0.00 H new ATOM 0 HB2 ASP B 85 12.647 10.667 7.113 1.00 0.00 H new ATOM 0 HB3 ASP B 85 14.069 10.373 8.095 1.00 0.00 H new ATOM 1296 N ASN B 86 15.469 12.917 5.433 1.00 0.00 N ATOM 1297 CA ASN B 86 16.382 12.644 4.325 1.00 0.00 C ATOM 1298 C ASN B 86 17.599 11.852 4.799 1.00 0.00 C ATOM 1299 O ASN B 86 18.163 12.140 5.855 1.00 0.00 O ATOM 1300 CB ASN B 86 16.835 13.952 3.675 1.00 0.00 C ATOM 1301 CG ASN B 86 15.675 14.755 3.120 1.00 0.00 C ATOM 1302 OD1 ASN B 86 14.767 15.145 3.854 1.00 0.00 O ATOM 1303 ND2 ASN B 86 15.700 15.005 1.816 1.00 0.00 N ATOM 0 H ASN B 86 15.308 13.908 5.612 1.00 0.00 H new ATOM 0 HA ASN B 86 15.846 12.045 3.589 1.00 0.00 H new ATOM 0 HB2 ASN B 86 17.370 14.553 4.410 1.00 0.00 H new ATOM 0 HB3 ASN B 86 17.537 13.731 2.871 1.00 0.00 H new ATOM 0 HD21 ASN B 86 14.946 15.540 1.385 1.00 0.00 H new ATOM 0 HD22 ASN B 86 16.473 14.662 1.246 1.00 0.00 H new ATOM 1310 N GLY B 87 17.998 10.856 4.012 1.00 0.00 N ATOM 1311 CA GLY B 87 19.147 10.042 4.370 1.00 0.00 C ATOM 1312 C GLY B 87 19.490 9.010 3.312 1.00 0.00 C ATOM 1313 O GLY B 87 20.648 8.888 2.911 1.00 0.00 O ATOM 0 H GLY B 87 17.547 10.598 3.134 1.00 0.00 H new ATOM 0 HA2 GLY B 87 20.009 10.690 4.532 1.00 0.00 H new ATOM 0 HA3 GLY B 87 18.947 9.535 5.314 1.00 0.00 H new ATOM 1317 N MET B 88 18.483 8.267 2.859 1.00 0.00 N ATOM 1318 CA MET B 88 18.684 7.239 1.840 1.00 0.00 C ATOM 1319 C MET B 88 17.355 6.621 1.418 1.00 0.00 C ATOM 1320 O MET B 88 16.370 6.673 2.157 1.00 0.00 O ATOM 1321 CB MET B 88 19.630 6.148 2.350 1.00 0.00 C ATOM 1322 CG MET B 88 19.150 5.463 3.618 1.00 0.00 C ATOM 1323 SD MET B 88 20.257 4.146 4.156 1.00 0.00 S ATOM 1324 CE MET B 88 21.785 5.055 4.380 1.00 0.00 C ATOM 0 H MET B 88 17.519 8.357 3.181 1.00 0.00 H new ATOM 0 HA MET B 88 19.135 7.717 0.970 1.00 0.00 H new ATOM 0 HB2 MET B 88 19.759 5.398 1.570 1.00 0.00 H new ATOM 0 HB3 MET B 88 20.610 6.587 2.535 1.00 0.00 H new ATOM 0 HG2 MET B 88 19.058 6.203 4.413 1.00 0.00 H new ATOM 0 HG3 MET B 88 18.155 5.050 3.449 1.00 0.00 H new ATOM 0 HE1 MET B 88 22.446 4.498 5.044 1.00 0.00 H new ATOM 0 HE2 MET B 88 22.272 5.191 3.414 1.00 0.00 H new ATOM 0 HE3 MET B 88 21.568 6.029 4.818 1.00 0.00 H new ATOM 1334 N THR B 89 17.334 6.048 0.218 1.00 0.00 N ATOM 1335 CA THR B 89 16.130 5.425 -0.323 1.00 0.00 C ATOM 1336 C THR B 89 15.517 4.428 0.657 1.00 0.00 C ATOM 1337 O THR B 89 14.301 4.395 0.835 1.00 0.00 O ATOM 1338 CB THR B 89 16.424 4.702 -1.653 1.00 0.00 C ATOM 1339 OG1 THR B 89 16.943 5.633 -2.611 1.00 0.00 O ATOM 1340 CG2 THR B 89 15.166 4.046 -2.210 1.00 0.00 C ATOM 0 H THR B 89 18.143 6.002 -0.402 1.00 0.00 H new ATOM 0 HA THR B 89 15.418 6.231 -0.497 1.00 0.00 H new ATOM 0 HB THR B 89 17.163 3.924 -1.459 1.00 0.00 H new ATOM 0 HG1 THR B 89 17.129 5.167 -3.453 1.00 0.00 H new ATOM 0 HG21 THR B 89 15.402 3.544 -3.148 1.00 0.00 H new ATOM 0 HG22 THR B 89 14.788 3.317 -1.493 1.00 0.00 H new ATOM 0 HG23 THR B 89 14.407 4.808 -2.388 1.00 0.00 H new ATOM 1348 N GLU B 90 16.361 3.609 1.283 1.00 0.00 N ATOM 1349 CA GLU B 90 15.886 2.603 2.232 1.00 0.00 C ATOM 1350 C GLU B 90 15.031 3.226 3.329 1.00 0.00 C ATOM 1351 O GLU B 90 14.013 2.661 3.718 1.00 0.00 O ATOM 1352 CB GLU B 90 17.057 1.851 2.864 1.00 0.00 C ATOM 1353 CG GLU B 90 17.984 1.199 1.853 1.00 0.00 C ATOM 1354 CD GLU B 90 19.127 0.451 2.510 1.00 0.00 C ATOM 1355 OE1 GLU B 90 19.923 1.094 3.226 1.00 0.00 O ATOM 1356 OE2 GLU B 90 19.224 -0.778 2.310 1.00 0.00 O ATOM 0 H GLU B 90 17.372 3.622 1.151 1.00 0.00 H new ATOM 0 HA GLU B 90 15.271 1.901 1.670 1.00 0.00 H new ATOM 0 HB2 GLU B 90 17.633 2.544 3.477 1.00 0.00 H new ATOM 0 HB3 GLU B 90 16.666 1.084 3.532 1.00 0.00 H new ATOM 0 HG2 GLU B 90 17.412 0.509 1.233 1.00 0.00 H new ATOM 0 HG3 GLU B 90 18.388 1.964 1.190 1.00 0.00 H new ATOM 1363 N GLU B 91 15.448 4.388 3.832 1.00 0.00 N ATOM 1364 CA GLU B 91 14.702 5.065 4.889 1.00 0.00 C ATOM 1365 C GLU B 91 13.234 5.204 4.501 1.00 0.00 C ATOM 1366 O GLU B 91 12.344 4.841 5.271 1.00 0.00 O ATOM 1367 CB GLU B 91 15.315 6.434 5.189 1.00 0.00 C ATOM 1368 CG GLU B 91 16.704 6.346 5.802 1.00 0.00 C ATOM 1369 CD GLU B 91 17.322 7.705 6.065 1.00 0.00 C ATOM 1370 OE1 GLU B 91 16.672 8.724 5.754 1.00 0.00 O ATOM 1371 OE2 GLU B 91 18.459 7.750 6.580 1.00 0.00 O ATOM 0 H GLU B 91 16.291 4.875 3.527 1.00 0.00 H new ATOM 0 HA GLU B 91 14.761 4.460 5.794 1.00 0.00 H new ATOM 0 HB2 GLU B 91 15.368 7.012 4.266 1.00 0.00 H new ATOM 0 HB3 GLU B 91 14.659 6.978 5.868 1.00 0.00 H new ATOM 0 HG2 GLU B 91 16.647 5.791 6.739 1.00 0.00 H new ATOM 0 HG3 GLU B 91 17.354 5.780 5.135 1.00 0.00 H new ATOM 1378 N LYS B 92 12.984 5.697 3.292 1.00 0.00 N ATOM 1379 CA LYS B 92 11.618 5.837 2.801 1.00 0.00 C ATOM 1380 C LYS B 92 11.020 4.457 2.571 1.00 0.00 C ATOM 1381 O LYS B 92 9.856 4.204 2.878 1.00 0.00 O ATOM 1382 CB LYS B 92 11.583 6.648 1.503 1.00 0.00 C ATOM 1383 CG LYS B 92 11.873 8.126 1.701 1.00 0.00 C ATOM 1384 CD LYS B 92 11.825 8.894 0.388 1.00 0.00 C ATOM 1385 CE LYS B 92 12.869 8.392 -0.597 1.00 0.00 C ATOM 1386 NZ LYS B 92 12.890 9.206 -1.844 1.00 0.00 N ATOM 0 H LYS B 92 13.704 6.004 2.638 1.00 0.00 H new ATOM 0 HA LYS B 92 11.031 6.371 3.548 1.00 0.00 H new ATOM 0 HB2 LYS B 92 12.311 6.234 0.806 1.00 0.00 H new ATOM 0 HB3 LYS B 92 10.602 6.538 1.042 1.00 0.00 H new ATOM 0 HG2 LYS B 92 11.147 8.549 2.396 1.00 0.00 H new ATOM 0 HG3 LYS B 92 12.856 8.245 2.156 1.00 0.00 H new ATOM 0 HD2 LYS B 92 10.833 8.798 -0.053 1.00 0.00 H new ATOM 0 HD3 LYS B 92 11.987 9.954 0.581 1.00 0.00 H new ATOM 0 HE2 LYS B 92 13.853 8.419 -0.129 1.00 0.00 H new ATOM 0 HE3 LYS B 92 12.663 7.351 -0.846 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 12.469 8.660 -2.622 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 12.344 10.079 -1.698 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 13.872 9.449 -2.084 1.00 0.00 H new ATOM 1400 N LEU B 93 11.846 3.564 2.037 1.00 0.00 N ATOM 1401 CA LEU B 93 11.440 2.194 1.767 1.00 0.00 C ATOM 1402 C LEU B 93 11.011 1.489 3.050 1.00 0.00 C ATOM 1403 O LEU B 93 10.230 0.544 3.016 1.00 0.00 O ATOM 1404 CB LEU B 93 12.593 1.419 1.127 1.00 0.00 C ATOM 1405 CG LEU B 93 13.053 1.912 -0.247 1.00 0.00 C ATOM 1406 CD1 LEU B 93 14.294 1.164 -0.689 1.00 0.00 C ATOM 1407 CD2 LEU B 93 11.956 1.747 -1.280 1.00 0.00 C ATOM 0 H LEU B 93 12.811 3.770 1.781 1.00 0.00 H new ATOM 0 HA LEU B 93 10.593 2.224 1.082 1.00 0.00 H new ATOM 0 HB2 LEU B 93 13.445 1.449 1.806 1.00 0.00 H new ATOM 0 HB3 LEU B 93 12.295 0.374 1.035 1.00 0.00 H new ATOM 0 HG LEU B 93 13.288 2.973 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU B 93 14.608 1.527 -1.668 1.00 0.00 H new ATOM 0 HD12 LEU B 93 15.094 1.328 0.033 1.00 0.00 H new ATOM 0 HD13 LEU B 93 14.074 0.098 -0.750 1.00 0.00 H new ATOM 0 HD21 LEU B 93 12.310 2.105 -2.247 1.00 0.00 H new ATOM 0 HD22 LEU B 93 11.687 0.694 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU B 93 11.082 2.323 -0.977 1.00 0.00 H new ATOM 1419 N ARG B 94 11.552 1.936 4.177 1.00 0.00 N ATOM 1420 CA ARG B 94 11.246 1.331 5.468 1.00 0.00 C ATOM 1421 C ARG B 94 9.894 1.782 6.012 1.00 0.00 C ATOM 1422 O ARG B 94 9.038 0.957 6.329 1.00 0.00 O ATOM 1423 CB ARG B 94 12.345 1.670 6.477 1.00 0.00 C ATOM 1424 CG ARG B 94 12.102 1.091 7.861 1.00 0.00 C ATOM 1425 CD ARG B 94 13.206 1.482 8.831 1.00 0.00 C ATOM 1426 NE ARG B 94 12.981 0.938 10.169 1.00 0.00 N ATOM 1427 CZ ARG B 94 11.942 1.261 10.935 1.00 0.00 C ATOM 1428 NH1 ARG B 94 11.040 2.135 10.507 1.00 0.00 N ATOM 1429 NH2 ARG B 94 11.807 0.712 12.134 1.00 0.00 N ATOM 0 H ARG B 94 12.206 2.717 4.223 1.00 0.00 H new ATOM 0 HA ARG B 94 11.198 0.253 5.317 1.00 0.00 H new ATOM 0 HB2 ARG B 94 13.299 1.300 6.100 1.00 0.00 H new ATOM 0 HB3 ARG B 94 12.432 2.754 6.556 1.00 0.00 H new ATOM 0 HG2 ARG B 94 11.142 1.442 8.240 1.00 0.00 H new ATOM 0 HG3 ARG B 94 12.041 0.005 7.796 1.00 0.00 H new ATOM 0 HD2 ARG B 94 14.164 1.126 8.452 1.00 0.00 H new ATOM 0 HD3 ARG B 94 13.270 2.569 8.888 1.00 0.00 H new ATOM 0 HE ARG B 94 13.660 0.272 10.537 1.00 0.00 H new ATOM 0 HH11 ARG B 94 11.141 2.563 9.587 1.00 0.00 H new ATOM 0 HH12 ARG B 94 10.246 2.379 11.098 1.00 0.00 H new ATOM 0 HH21 ARG B 94 12.499 0.042 12.469 1.00 0.00 H new ATOM 0 HH22 ARG B 94 11.011 0.959 12.721 1.00 0.00 H new ATOM 1443 N ARG B 95 9.715 3.093 6.145 1.00 0.00 N ATOM 1444 CA ARG B 95 8.475 3.643 6.682 1.00 0.00 C ATOM 1445 C ARG B 95 7.310 3.521 5.704 1.00 0.00 C ATOM 1446 O ARG B 95 6.249 3.012 6.059 1.00 0.00 O ATOM 1447 CB ARG B 95 8.671 5.107 7.084 1.00 0.00 C ATOM 1448 CG ARG B 95 9.220 5.981 5.970 1.00 0.00 C ATOM 1449 CD ARG B 95 9.338 7.433 6.404 1.00 0.00 C ATOM 1450 NE ARG B 95 8.043 8.004 6.762 1.00 0.00 N ATOM 1451 CZ ARG B 95 7.878 9.258 7.173 1.00 0.00 C ATOM 1452 NH1 ARG B 95 8.923 10.066 7.283 1.00 0.00 N ATOM 1453 NH2 ARG B 95 6.666 9.704 7.476 1.00 0.00 N ATOM 0 H ARG B 95 10.411 3.793 5.889 1.00 0.00 H new ATOM 0 HA ARG B 95 8.222 3.053 7.563 1.00 0.00 H new ATOM 0 HB2 ARG B 95 7.716 5.514 7.415 1.00 0.00 H new ATOM 0 HB3 ARG B 95 9.349 5.152 7.936 1.00 0.00 H new ATOM 0 HG2 ARG B 95 10.199 5.611 5.666 1.00 0.00 H new ATOM 0 HG3 ARG B 95 8.568 5.913 5.099 1.00 0.00 H new ATOM 0 HD2 ARG B 95 10.013 7.503 7.257 1.00 0.00 H new ATOM 0 HD3 ARG B 95 9.781 8.017 5.598 1.00 0.00 H new ATOM 0 HE ARG B 95 7.218 7.408 6.693 1.00 0.00 H new ATOM 0 HH11 ARG B 95 9.857 9.726 7.052 1.00 0.00 H new ATOM 0 HH12 ARG B 95 8.793 11.027 7.598 1.00 0.00 H new ATOM 0 HH21 ARG B 95 5.859 9.085 7.394 1.00 0.00 H new ATOM 0 HH22 ARG B 95 6.541 10.666 7.791 1.00 0.00 H new ATOM 1467 N TYR B 96 7.495 4.004 4.481 1.00 0.00 N ATOM 1468 CA TYR B 96 6.432 3.956 3.483 1.00 0.00 C ATOM 1469 C TYR B 96 5.964 2.530 3.203 1.00 0.00 C ATOM 1470 O TYR B 96 4.769 2.292 3.058 1.00 0.00 O ATOM 1471 CB TYR B 96 6.872 4.633 2.183 1.00 0.00 C ATOM 1472 CG TYR B 96 7.029 6.132 2.307 1.00 0.00 C ATOM 1473 CD1 TYR B 96 8.157 6.688 2.896 1.00 0.00 C ATOM 1474 CD2 TYR B 96 6.040 6.993 1.842 1.00 0.00 C ATOM 1475 CE1 TYR B 96 8.297 8.058 3.017 1.00 0.00 C ATOM 1476 CE2 TYR B 96 6.175 8.363 1.958 1.00 0.00 C ATOM 1477 CZ TYR B 96 7.305 8.890 2.546 1.00 0.00 C ATOM 1478 OH TYR B 96 7.442 10.255 2.664 1.00 0.00 O ATOM 0 H TYR B 96 8.363 4.430 4.158 1.00 0.00 H new ATOM 0 HA TYR B 96 5.586 4.503 3.899 1.00 0.00 H new ATOM 0 HB2 TYR B 96 7.820 4.202 1.861 1.00 0.00 H new ATOM 0 HB3 TYR B 96 6.141 4.415 1.404 1.00 0.00 H new ATOM 0 HD1 TYR B 96 8.938 6.040 3.266 1.00 0.00 H new ATOM 0 HD2 TYR B 96 5.152 6.584 1.383 1.00 0.00 H new ATOM 0 HE1 TYR B 96 9.180 8.474 3.479 1.00 0.00 H new ATOM 0 HE2 TYR B 96 5.399 9.018 1.590 1.00 0.00 H new ATOM 0 HH TYR B 96 6.655 10.697 2.282 1.00 0.00 H new ATOM 1488 N LEU B 97 6.895 1.585 3.118 1.00 0.00 N ATOM 1489 CA LEU B 97 6.531 0.195 2.841 1.00 0.00 C ATOM 1490 C LEU B 97 5.686 -0.398 3.966 1.00 0.00 C ATOM 1491 O LEU B 97 4.591 -0.902 3.722 1.00 0.00 O ATOM 1492 CB LEU B 97 7.786 -0.655 2.614 1.00 0.00 C ATOM 1493 CG LEU B 97 7.543 -2.135 2.279 1.00 0.00 C ATOM 1494 CD1 LEU B 97 7.137 -2.916 3.521 1.00 0.00 C ATOM 1495 CD2 LEU B 97 6.483 -2.272 1.194 1.00 0.00 C ATOM 0 H LEU B 97 7.895 1.750 3.235 1.00 0.00 H new ATOM 0 HA LEU B 97 5.930 0.187 1.932 1.00 0.00 H new ATOM 0 HB2 LEU B 97 8.362 -0.209 1.803 1.00 0.00 H new ATOM 0 HB3 LEU B 97 8.404 -0.602 3.510 1.00 0.00 H new ATOM 0 HG LEU B 97 8.478 -2.553 1.906 1.00 0.00 H new ATOM 0 HD11 LEU B 97 6.971 -3.960 3.256 1.00 0.00 H new ATOM 0 HD12 LEU B 97 7.930 -2.852 4.266 1.00 0.00 H new ATOM 0 HD13 LEU B 97 6.219 -2.496 3.931 1.00 0.00 H new ATOM 0 HD21 LEU B 97 6.325 -3.327 0.971 1.00 0.00 H new ATOM 0 HD22 LEU B 97 5.549 -1.831 1.540 1.00 0.00 H new ATOM 0 HD23 LEU B 97 6.816 -1.756 0.293 1.00 0.00 H new ATOM 1507 N LYS B 98 6.192 -0.346 5.193 1.00 0.00 N ATOM 1508 CA LYS B 98 5.459 -0.893 6.329 1.00 0.00 C ATOM 1509 C LYS B 98 4.090 -0.232 6.438 1.00 0.00 C ATOM 1510 O LYS B 98 3.097 -0.882 6.766 1.00 0.00 O ATOM 1511 CB LYS B 98 6.245 -0.706 7.630 1.00 0.00 C ATOM 1512 CG LYS B 98 6.473 0.746 8.013 1.00 0.00 C ATOM 1513 CD LYS B 98 7.225 0.861 9.328 1.00 0.00 C ATOM 1514 CE LYS B 98 7.420 2.313 9.735 1.00 0.00 C ATOM 1515 NZ LYS B 98 6.120 3.022 9.900 1.00 0.00 N ATOM 0 H LYS B 98 7.096 0.064 5.425 1.00 0.00 H new ATOM 0 HA LYS B 98 5.324 -1.962 6.166 1.00 0.00 H new ATOM 0 HB2 LYS B 98 5.711 -1.205 8.439 1.00 0.00 H new ATOM 0 HB3 LYS B 98 7.211 -1.201 7.533 1.00 0.00 H new ATOM 0 HG2 LYS B 98 7.035 1.248 7.225 1.00 0.00 H new ATOM 0 HG3 LYS B 98 5.514 1.257 8.095 1.00 0.00 H new ATOM 0 HD2 LYS B 98 6.677 0.334 10.109 1.00 0.00 H new ATOM 0 HD3 LYS B 98 8.196 0.374 9.236 1.00 0.00 H new ATOM 0 HE2 LYS B 98 7.979 2.356 10.670 1.00 0.00 H new ATOM 0 HE3 LYS B 98 8.019 2.824 8.982 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 6.002 3.714 9.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 5.342 2.333 9.867 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 6.107 3.515 10.816 1.00 0.00 H new ATOM 1529 N ARG B 99 4.050 1.062 6.148 1.00 0.00 N ATOM 1530 CA ARG B 99 2.810 1.824 6.196 1.00 0.00 C ATOM 1531 C ARG B 99 1.874 1.418 5.064 1.00 0.00 C ATOM 1532 O ARG B 99 0.664 1.331 5.254 1.00 0.00 O ATOM 1533 CB ARG B 99 3.103 3.320 6.104 1.00 0.00 C ATOM 1534 CG ARG B 99 3.820 3.878 7.322 1.00 0.00 C ATOM 1535 CD ARG B 99 4.180 5.343 7.137 1.00 0.00 C ATOM 1536 NE ARG B 99 4.835 5.902 8.317 1.00 0.00 N ATOM 1537 CZ ARG B 99 4.241 6.025 9.501 1.00 0.00 C ATOM 1538 NH1 ARG B 99 2.978 5.650 9.658 1.00 0.00 N ATOM 1539 NH2 ARG B 99 4.910 6.530 10.529 1.00 0.00 N ATOM 0 H ARG B 99 4.867 1.608 5.876 1.00 0.00 H new ATOM 0 HA ARG B 99 2.322 1.608 7.146 1.00 0.00 H new ATOM 0 HB2 ARG B 99 3.710 3.509 5.218 1.00 0.00 H new ATOM 0 HB3 ARG B 99 2.164 3.857 5.968 1.00 0.00 H new ATOM 0 HG2 ARG B 99 3.185 3.767 8.201 1.00 0.00 H new ATOM 0 HG3 ARG B 99 4.726 3.301 7.508 1.00 0.00 H new ATOM 0 HD2 ARG B 99 4.838 5.448 6.274 1.00 0.00 H new ATOM 0 HD3 ARG B 99 3.277 5.913 6.920 1.00 0.00 H new ATOM 0 HE ARG B 99 5.802 6.215 8.228 1.00 0.00 H new ATOM 0 HH11 ARG B 99 2.458 5.265 8.869 1.00 0.00 H new ATOM 0 HH12 ARG B 99 2.527 5.746 10.568 1.00 0.00 H new ATOM 0 HH21 ARG B 99 5.880 6.824 10.412 1.00 0.00 H new ATOM 0 HH22 ARG B 99 4.455 6.624 11.437 1.00 0.00 H new ATOM 1553 N THR B 100 2.444 1.192 3.884 1.00 0.00 N ATOM 1554 CA THR B 100 1.661 0.816 2.712 1.00 0.00 C ATOM 1555 C THR B 100 1.057 -0.571 2.831 1.00 0.00 C ATOM 1556 O THR B 100 -0.154 -0.730 2.713 1.00 0.00 O ATOM 1557 CB THR B 100 2.499 0.855 1.430 1.00 0.00 C ATOM 1558 OG1 THR B 100 3.726 0.144 1.616 1.00 0.00 O ATOM 1559 CG2 THR B 100 2.787 2.277 1.008 1.00 0.00 C ATOM 0 H THR B 100 3.447 1.263 3.714 1.00 0.00 H new ATOM 0 HA THR B 100 0.860 1.553 2.659 1.00 0.00 H new ATOM 0 HB THR B 100 1.923 0.374 0.640 1.00 0.00 H new ATOM 0 HG1 THR B 100 3.856 -0.484 0.875 1.00 0.00 H new ATOM 0 HG21 THR B 100 3.383 2.272 0.096 1.00 0.00 H new ATOM 0 HG22 THR B 100 1.848 2.800 0.825 1.00 0.00 H new ATOM 0 HG23 THR B 100 3.338 2.787 1.799 1.00 0.00 H new ATOM 1567 N VAL B 101 1.899 -1.580 3.046 1.00 0.00 N ATOM 1568 CA VAL B 101 1.405 -2.944 3.158 1.00 0.00 C ATOM 1569 C VAL B 101 0.281 -3.004 4.184 1.00 0.00 C ATOM 1570 O VAL B 101 -0.719 -3.696 3.987 1.00 0.00 O ATOM 1571 CB VAL B 101 2.517 -3.953 3.518 1.00 0.00 C ATOM 1572 CG1 VAL B 101 3.640 -3.922 2.495 1.00 0.00 C ATOM 1573 CG2 VAL B 101 3.064 -3.717 4.911 1.00 0.00 C ATOM 0 H VAL B 101 2.909 -1.479 3.144 1.00 0.00 H new ATOM 0 HA VAL B 101 1.025 -3.233 2.178 1.00 0.00 H new ATOM 0 HB VAL B 101 2.063 -4.944 3.502 1.00 0.00 H new ATOM 0 HG11 VAL B 101 4.408 -4.643 2.776 1.00 0.00 H new ATOM 0 HG12 VAL B 101 3.244 -4.178 1.512 1.00 0.00 H new ATOM 0 HG13 VAL B 101 4.075 -2.923 2.462 1.00 0.00 H new ATOM 0 HG21 VAL B 101 3.844 -4.448 5.124 1.00 0.00 H new ATOM 0 HG22 VAL B 101 3.482 -2.712 4.972 1.00 0.00 H new ATOM 0 HG23 VAL B 101 2.260 -3.821 5.640 1.00 0.00 H new ATOM 1583 N THR B 102 0.432 -2.237 5.261 1.00 0.00 N ATOM 1584 CA THR B 102 -0.589 -2.164 6.294 1.00 0.00 C ATOM 1585 C THR B 102 -1.753 -1.315 5.798 1.00 0.00 C ATOM 1586 O THR B 102 -2.916 -1.603 6.079 1.00 0.00 O ATOM 1587 CB THR B 102 -0.042 -1.560 7.602 1.00 0.00 C ATOM 1588 OG1 THR B 102 1.019 -2.376 8.112 1.00 0.00 O ATOM 1589 CG2 THR B 102 -1.143 -1.442 8.647 1.00 0.00 C ATOM 0 H THR B 102 1.253 -1.658 5.438 1.00 0.00 H new ATOM 0 HA THR B 102 -0.920 -3.181 6.506 1.00 0.00 H new ATOM 0 HB THR B 102 0.339 -0.562 7.383 1.00 0.00 H new ATOM 0 HG1 THR B 102 1.877 -2.047 7.772 1.00 0.00 H new ATOM 0 HG21 THR B 102 -0.733 -1.013 9.561 1.00 0.00 H new ATOM 0 HG22 THR B 102 -1.936 -0.798 8.268 1.00 0.00 H new ATOM 0 HG23 THR B 102 -1.549 -2.431 8.861 1.00 0.00 H new ATOM 1597 N GLU B 103 -1.418 -0.271 5.040 1.00 0.00 N ATOM 1598 CA GLU B 103 -2.420 0.624 4.478 1.00 0.00 C ATOM 1599 C GLU B 103 -3.376 -0.176 3.605 1.00 0.00 C ATOM 1600 O GLU B 103 -4.583 0.061 3.606 1.00 0.00 O ATOM 1601 CB GLU B 103 -1.752 1.736 3.660 1.00 0.00 C ATOM 1602 CG GLU B 103 -2.623 2.963 3.467 1.00 0.00 C ATOM 1603 CD GLU B 103 -2.961 3.652 4.775 1.00 0.00 C ATOM 1604 OE1 GLU B 103 -2.024 4.095 5.471 1.00 0.00 O ATOM 1605 OE2 GLU B 103 -4.163 3.750 5.101 1.00 0.00 O ATOM 0 H GLU B 103 -0.457 -0.027 4.803 1.00 0.00 H new ATOM 0 HA GLU B 103 -2.978 1.091 5.290 1.00 0.00 H new ATOM 0 HB2 GLU B 103 -0.827 2.033 4.155 1.00 0.00 H new ATOM 0 HB3 GLU B 103 -1.477 1.340 2.682 1.00 0.00 H new ATOM 0 HG2 GLU B 103 -2.111 3.668 2.812 1.00 0.00 H new ATOM 0 HG3 GLU B 103 -3.546 2.673 2.965 1.00 0.00 H new ATOM 1612 N LEU B 104 -2.822 -1.150 2.882 1.00 0.00 N ATOM 1613 CA LEU B 104 -3.623 -2.015 2.028 1.00 0.00 C ATOM 1614 C LEU B 104 -4.581 -2.808 2.885 1.00 0.00 C ATOM 1615 O LEU B 104 -5.785 -2.819 2.652 1.00 0.00 O ATOM 1616 CB LEU B 104 -2.745 -3.003 1.263 1.00 0.00 C ATOM 1617 CG LEU B 104 -1.624 -2.400 0.436 1.00 0.00 C ATOM 1618 CD1 LEU B 104 -0.881 -3.496 -0.297 1.00 0.00 C ATOM 1619 CD2 LEU B 104 -2.173 -1.394 -0.551 1.00 0.00 C ATOM 0 H LEU B 104 -1.823 -1.356 2.873 1.00 0.00 H new ATOM 0 HA LEU B 104 -4.158 -1.386 1.317 1.00 0.00 H new ATOM 0 HB2 LEU B 104 -2.307 -3.698 1.979 1.00 0.00 H new ATOM 0 HB3 LEU B 104 -3.383 -3.588 0.601 1.00 0.00 H new ATOM 0 HG LEU B 104 -0.934 -1.885 1.105 1.00 0.00 H new ATOM 0 HD11 LEU B 104 -0.078 -3.058 -0.889 1.00 0.00 H new ATOM 0 HD12 LEU B 104 -0.460 -4.196 0.425 1.00 0.00 H new ATOM 0 HD13 LEU B 104 -1.570 -4.025 -0.956 1.00 0.00 H new ATOM 0 HD21 LEU B 104 -1.354 -0.973 -1.134 1.00 0.00 H new ATOM 0 HD22 LEU B 104 -2.878 -1.888 -1.219 1.00 0.00 H new ATOM 0 HD23 LEU B 104 -2.682 -0.596 -0.011 1.00 0.00 H new ATOM 1631 N ASP B 105 -4.016 -3.470 3.887 1.00 0.00 N ATOM 1632 CA ASP B 105 -4.790 -4.278 4.809 1.00 0.00 C ATOM 1633 C ASP B 105 -5.959 -3.470 5.352 1.00 0.00 C ATOM 1634 O ASP B 105 -7.020 -4.014 5.644 1.00 0.00 O ATOM 1635 CB ASP B 105 -3.896 -4.764 5.952 1.00 0.00 C ATOM 1636 CG ASP B 105 -4.586 -5.771 6.851 1.00 0.00 C ATOM 1637 OD1 ASP B 105 -5.750 -6.124 6.568 1.00 0.00 O ATOM 1638 OD2 ASP B 105 -3.959 -6.214 7.836 1.00 0.00 O ATOM 0 H ASP B 105 -3.014 -3.460 4.079 1.00 0.00 H new ATOM 0 HA ASP B 105 -5.184 -5.147 4.282 1.00 0.00 H new ATOM 0 HB2 ASP B 105 -2.994 -5.213 5.536 1.00 0.00 H new ATOM 0 HB3 ASP B 105 -3.580 -3.908 6.549 1.00 0.00 H new ATOM 1643 N SER B 106 -5.753 -2.162 5.477 1.00 0.00 N ATOM 1644 CA SER B 106 -6.789 -1.269 5.978 1.00 0.00 C ATOM 1645 C SER B 106 -7.882 -1.050 4.933 1.00 0.00 C ATOM 1646 O SER B 106 -9.043 -1.384 5.162 1.00 0.00 O ATOM 1647 CB SER B 106 -6.179 0.073 6.383 1.00 0.00 C ATOM 1648 OG SER B 106 -7.167 0.952 6.890 1.00 0.00 O ATOM 0 H SER B 106 -4.877 -1.698 5.238 1.00 0.00 H new ATOM 0 HA SER B 106 -7.242 -1.737 6.852 1.00 0.00 H new ATOM 0 HB2 SER B 106 -5.409 -0.087 7.138 1.00 0.00 H new ATOM 0 HB3 SER B 106 -5.691 0.528 5.521 1.00 0.00 H new ATOM 0 HG SER B 106 -6.750 1.802 7.143 1.00 0.00 H new ATOM 1654 N VAL B 107 -7.510 -0.488 3.784 1.00 0.00 N ATOM 1655 CA VAL B 107 -8.472 -0.228 2.716 1.00 0.00 C ATOM 1656 C VAL B 107 -9.199 -1.498 2.285 1.00 0.00 C ATOM 1657 O VAL B 107 -10.418 -1.499 2.140 1.00 0.00 O ATOM 1658 CB VAL B 107 -7.809 0.399 1.474 1.00 0.00 C ATOM 1659 CG1 VAL B 107 -7.578 1.885 1.654 1.00 0.00 C ATOM 1660 CG2 VAL B 107 -6.503 -0.299 1.152 1.00 0.00 C ATOM 0 H VAL B 107 -6.554 -0.205 3.570 1.00 0.00 H new ATOM 0 HA VAL B 107 -9.189 0.479 3.134 1.00 0.00 H new ATOM 0 HB VAL B 107 -8.495 0.265 0.638 1.00 0.00 H new ATOM 0 HG11 VAL B 107 -7.109 2.292 0.758 1.00 0.00 H new ATOM 0 HG12 VAL B 107 -8.532 2.384 1.822 1.00 0.00 H new ATOM 0 HG13 VAL B 107 -6.926 2.051 2.512 1.00 0.00 H new ATOM 0 HG21 VAL B 107 -6.053 0.160 0.272 1.00 0.00 H new ATOM 0 HG22 VAL B 107 -5.822 -0.206 1.998 1.00 0.00 H new ATOM 0 HG23 VAL B 107 -6.693 -1.354 0.954 1.00 0.00 H new ATOM 1670 N THR B 108 -8.445 -2.571 2.064 1.00 0.00 N ATOM 1671 CA THR B 108 -9.026 -3.838 1.631 1.00 0.00 C ATOM 1672 C THR B 108 -9.984 -4.402 2.679 1.00 0.00 C ATOM 1673 O THR B 108 -11.031 -4.954 2.339 1.00 0.00 O ATOM 1674 CB THR B 108 -7.939 -4.888 1.318 1.00 0.00 C ATOM 1675 OG1 THR B 108 -8.534 -6.040 0.709 1.00 0.00 O ATOM 1676 CG2 THR B 108 -7.202 -5.311 2.580 1.00 0.00 C ATOM 0 H THR B 108 -7.431 -2.589 2.177 1.00 0.00 H new ATOM 0 HA THR B 108 -9.582 -3.626 0.718 1.00 0.00 H new ATOM 0 HB THR B 108 -7.222 -4.435 0.633 1.00 0.00 H new ATOM 0 HG1 THR B 108 -7.839 -6.702 0.512 1.00 0.00 H new ATOM 0 HG21 THR B 108 -6.443 -6.051 2.327 1.00 0.00 H new ATOM 0 HG22 THR B 108 -6.725 -4.441 3.031 1.00 0.00 H new ATOM 0 HG23 THR B 108 -7.910 -5.744 3.287 1.00 0.00 H new ATOM 1684 N ALA B 109 -9.618 -4.267 3.950 1.00 0.00 N ATOM 1685 CA ALA B 109 -10.446 -4.770 5.042 1.00 0.00 C ATOM 1686 C ALA B 109 -11.808 -4.086 5.065 1.00 0.00 C ATOM 1687 O ALA B 109 -12.839 -4.739 5.215 1.00 0.00 O ATOM 1688 CB ALA B 109 -9.740 -4.580 6.375 1.00 0.00 C ATOM 0 H ALA B 109 -8.755 -3.814 4.249 1.00 0.00 H new ATOM 0 HA ALA B 109 -10.606 -5.835 4.875 1.00 0.00 H new ATOM 0 HB1 ALA B 109 -10.371 -4.960 7.178 1.00 0.00 H new ATOM 0 HB2 ALA B 109 -8.795 -5.124 6.367 1.00 0.00 H new ATOM 0 HB3 ALA B 109 -9.547 -3.519 6.536 1.00 0.00 H new ATOM 1694 N ARG B 110 -11.806 -2.767 4.923 1.00 0.00 N ATOM 1695 CA ARG B 110 -13.044 -1.996 4.929 1.00 0.00 C ATOM 1696 C ARG B 110 -13.759 -2.093 3.585 1.00 0.00 C ATOM 1697 O ARG B 110 -14.986 -2.059 3.524 1.00 0.00 O ATOM 1698 CB ARG B 110 -12.769 -0.530 5.282 1.00 0.00 C ATOM 1699 CG ARG B 110 -12.396 -0.306 6.744 1.00 0.00 C ATOM 1700 CD ARG B 110 -11.079 -0.978 7.103 1.00 0.00 C ATOM 1701 NE ARG B 110 -10.724 -0.789 8.508 1.00 0.00 N ATOM 1702 CZ ARG B 110 -11.429 -1.283 9.522 1.00 0.00 C ATOM 1703 NH1 ARG B 110 -12.520 -2.001 9.291 1.00 0.00 N ATOM 1704 NH2 ARG B 110 -11.037 -1.063 10.770 1.00 0.00 N ATOM 0 H ARG B 110 -10.961 -2.208 4.802 1.00 0.00 H new ATOM 0 HA ARG B 110 -13.696 -2.421 5.692 1.00 0.00 H new ATOM 0 HB2 ARG B 110 -11.962 -0.160 4.650 1.00 0.00 H new ATOM 0 HB3 ARG B 110 -13.654 0.062 5.048 1.00 0.00 H new ATOM 0 HG2 ARG B 110 -12.323 0.764 6.940 1.00 0.00 H new ATOM 0 HG3 ARG B 110 -13.188 -0.694 7.384 1.00 0.00 H new ATOM 0 HD2 ARG B 110 -11.148 -2.044 6.888 1.00 0.00 H new ATOM 0 HD3 ARG B 110 -10.285 -0.576 6.473 1.00 0.00 H new ATOM 0 HE ARG B 110 -9.887 -0.247 8.723 1.00 0.00 H new ATOM 0 HH11 ARG B 110 -12.822 -2.176 8.333 1.00 0.00 H new ATOM 0 HH12 ARG B 110 -13.057 -2.378 10.072 1.00 0.00 H new ATOM 0 HH21 ARG B 110 -10.196 -0.515 10.951 1.00 0.00 H new ATOM 0 HH22 ARG B 110 -11.577 -1.441 11.548 1.00 0.00 H new ATOM 1718 N LEU B 111 -12.984 -2.212 2.510 1.00 0.00 N ATOM 1719 CA LEU B 111 -13.547 -2.312 1.165 1.00 0.00 C ATOM 1720 C LEU B 111 -14.431 -3.546 1.025 1.00 0.00 C ATOM 1721 O LEU B 111 -15.554 -3.460 0.538 1.00 0.00 O ATOM 1722 CB LEU B 111 -12.435 -2.355 0.114 1.00 0.00 C ATOM 1723 CG LEU B 111 -12.898 -2.692 -1.308 1.00 0.00 C ATOM 1724 CD1 LEU B 111 -13.919 -1.676 -1.794 1.00 0.00 C ATOM 1725 CD2 LEU B 111 -11.712 -2.752 -2.256 1.00 0.00 C ATOM 0 H LEU B 111 -11.965 -2.242 2.543 1.00 0.00 H new ATOM 0 HA LEU B 111 -14.160 -1.426 1.002 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -11.935 -1.387 0.097 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -11.693 -3.092 0.422 1.00 0.00 H new ATOM 0 HG LEU B 111 -13.373 -3.673 -1.290 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -14.235 -1.933 -2.805 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -14.784 -1.683 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -13.471 -0.682 -1.795 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -12.061 -2.992 -3.260 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -11.207 -1.786 -2.269 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -11.016 -3.521 -1.920 1.00 0.00 H new ATOM 1737 N ARG B 112 -13.915 -4.692 1.448 1.00 0.00 N ATOM 1738 CA ARG B 112 -14.663 -5.939 1.359 1.00 0.00 C ATOM 1739 C ARG B 112 -16.001 -5.828 2.086 1.00 0.00 C ATOM 1740 O ARG B 112 -16.992 -6.431 1.674 1.00 0.00 O ATOM 1741 CB ARG B 112 -13.845 -7.096 1.938 1.00 0.00 C ATOM 1742 CG ARG B 112 -13.457 -6.898 3.393 1.00 0.00 C ATOM 1743 CD ARG B 112 -12.655 -8.075 3.925 1.00 0.00 C ATOM 1744 NE ARG B 112 -12.268 -7.885 5.320 1.00 0.00 N ATOM 1745 CZ ARG B 112 -11.572 -8.774 6.023 1.00 0.00 C ATOM 1746 NH1 ARG B 112 -11.190 -9.915 5.463 1.00 0.00 N ATOM 1747 NH2 ARG B 112 -11.257 -8.524 7.286 1.00 0.00 N ATOM 0 H ARG B 112 -12.984 -4.784 1.855 1.00 0.00 H new ATOM 0 HA ARG B 112 -14.860 -6.138 0.306 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -14.419 -8.018 1.846 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -12.940 -7.224 1.344 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -12.872 -5.984 3.493 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -14.356 -6.768 3.995 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -13.245 -8.987 3.833 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -11.761 -8.210 3.316 1.00 0.00 H new ATOM 0 HE ARG B 112 -12.548 -7.020 5.782 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -11.430 -10.112 4.491 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -10.656 -10.595 6.004 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -11.548 -7.648 7.721 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -10.723 -9.207 7.823 1.00 0.00 H new ATOM 1761 N GLU B 113 -16.019 -5.067 3.177 1.00 0.00 N ATOM 1762 CA GLU B 113 -17.233 -4.893 3.965 1.00 0.00 C ATOM 1763 C GLU B 113 -18.190 -3.876 3.339 1.00 0.00 C ATOM 1764 O GLU B 113 -19.392 -4.128 3.257 1.00 0.00 O ATOM 1765 CB GLU B 113 -16.889 -4.478 5.396 1.00 0.00 C ATOM 1766 CG GLU B 113 -18.108 -4.365 6.300 1.00 0.00 C ATOM 1767 CD GLU B 113 -17.747 -4.045 7.738 1.00 0.00 C ATOM 1768 OE1 GLU B 113 -16.540 -3.921 8.034 1.00 0.00 O ATOM 1769 OE2 GLU B 113 -18.671 -3.923 8.567 1.00 0.00 O ATOM 0 H GLU B 113 -15.208 -4.562 3.534 1.00 0.00 H new ATOM 0 HA GLU B 113 -17.743 -5.856 3.981 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -16.196 -5.204 5.821 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -16.371 -3.519 5.374 1.00 0.00 H new ATOM 0 HG2 GLU B 113 -18.769 -3.589 5.915 1.00 0.00 H new ATOM 0 HG3 GLU B 113 -18.665 -5.302 6.270 1.00 0.00 H new ATOM 1776 N VAL B 114 -17.667 -2.725 2.904 1.00 0.00 N ATOM 1777 CA VAL B 114 -18.518 -1.699 2.302 1.00 0.00 C ATOM 1778 C VAL B 114 -19.328 -2.280 1.148 1.00 0.00 C ATOM 1779 O VAL B 114 -20.536 -2.059 1.059 1.00 0.00 O ATOM 1780 CB VAL B 114 -17.725 -0.459 1.822 1.00 0.00 C ATOM 1781 CG1 VAL B 114 -17.188 0.320 3.008 1.00 0.00 C ATOM 1782 CG2 VAL B 114 -16.591 -0.838 0.889 1.00 0.00 C ATOM 0 H VAL B 114 -16.677 -2.485 2.956 1.00 0.00 H new ATOM 0 HA VAL B 114 -19.193 -1.361 3.088 1.00 0.00 H new ATOM 0 HB VAL B 114 -18.416 0.171 1.263 1.00 0.00 H new ATOM 0 HG11 VAL B 114 -16.633 1.188 2.652 1.00 0.00 H new ATOM 0 HG12 VAL B 114 -18.018 0.651 3.632 1.00 0.00 H new ATOM 0 HG13 VAL B 114 -16.526 -0.318 3.593 1.00 0.00 H new ATOM 0 HG21 VAL B 114 -16.061 0.062 0.576 1.00 0.00 H new ATOM 0 HG22 VAL B 114 -15.901 -1.504 1.407 1.00 0.00 H new ATOM 0 HG23 VAL B 114 -16.995 -1.344 0.012 1.00 0.00 H new ATOM 1792 N GLU B 115 -18.671 -3.051 0.287 1.00 0.00 N ATOM 1793 CA GLU B 115 -19.359 -3.688 -0.828 1.00 0.00 C ATOM 1794 C GLU B 115 -20.180 -4.872 -0.316 1.00 0.00 C ATOM 1795 O GLU B 115 -21.078 -4.689 0.507 1.00 0.00 O ATOM 1796 CB GLU B 115 -18.364 -4.125 -1.913 1.00 0.00 C ATOM 1797 CG GLU B 115 -17.204 -4.956 -1.395 1.00 0.00 C ATOM 1798 CD GLU B 115 -16.244 -5.364 -2.496 1.00 0.00 C ATOM 1799 OE1 GLU B 115 -15.691 -4.464 -3.164 1.00 0.00 O ATOM 1800 OE2 GLU B 115 -16.046 -6.581 -2.690 1.00 0.00 O ATOM 0 H GLU B 115 -17.672 -3.248 0.340 1.00 0.00 H new ATOM 0 HA GLU B 115 -20.036 -2.966 -1.285 1.00 0.00 H new ATOM 0 HB2 GLU B 115 -18.898 -4.699 -2.670 1.00 0.00 H new ATOM 0 HB3 GLU B 115 -17.969 -3.237 -2.406 1.00 0.00 H new ATOM 0 HG2 GLU B 115 -16.663 -4.387 -0.638 1.00 0.00 H new ATOM 0 HG3 GLU B 115 -17.591 -5.850 -0.906 1.00 0.00 H new ATOM 1807 N HIS B 116 -19.874 -6.079 -0.787 1.00 0.00 N ATOM 1808 CA HIS B 116 -20.597 -7.268 -0.351 1.00 0.00 C ATOM 1809 C HIS B 116 -22.086 -7.110 -0.647 1.00 0.00 C ATOM 1810 O HIS B 116 -22.939 -7.691 0.025 1.00 0.00 O ATOM 1811 CB HIS B 116 -20.362 -7.491 1.149 1.00 0.00 C ATOM 1812 CG HIS B 116 -20.903 -8.785 1.673 1.00 0.00 C ATOM 1813 ND1 HIS B 116 -20.497 -10.017 1.207 1.00 0.00 N ATOM 1814 CD2 HIS B 116 -21.816 -9.034 2.642 1.00 0.00 C ATOM 1815 CE1 HIS B 116 -21.137 -10.967 1.864 1.00 0.00 C ATOM 1816 NE2 HIS B 116 -21.942 -10.398 2.741 1.00 0.00 N ATOM 0 H HIS B 116 -19.135 -6.258 -1.467 1.00 0.00 H new ATOM 0 HA HIS B 116 -20.230 -8.138 -0.896 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -19.291 -7.452 1.346 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -20.818 -6.670 1.702 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -22.346 -8.297 3.228 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -21.021 -12.030 1.710 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -22.558 -10.891 3.388 1.00 0.00 H new ATOM 1825 N ARG B 117 -22.377 -6.310 -1.668 1.00 0.00 N ATOM 1826 CA ARG B 117 -23.747 -6.043 -2.090 1.00 0.00 C ATOM 1827 C ARG B 117 -23.750 -5.038 -3.235 1.00 0.00 C ATOM 1828 O ARG B 117 -24.603 -5.087 -4.121 1.00 0.00 O ATOM 1829 CB ARG B 117 -24.583 -5.508 -0.922 1.00 0.00 C ATOM 1830 CG ARG B 117 -24.075 -4.190 -0.358 1.00 0.00 C ATOM 1831 CD ARG B 117 -24.930 -3.718 0.807 1.00 0.00 C ATOM 1832 NE ARG B 117 -26.328 -3.540 0.423 1.00 0.00 N ATOM 1833 CZ ARG B 117 -27.279 -3.140 1.263 1.00 0.00 C ATOM 1834 NH1 ARG B 117 -26.983 -2.873 2.528 1.00 0.00 N ATOM 1835 NH2 ARG B 117 -28.527 -3.004 0.836 1.00 0.00 N ATOM 0 H ARG B 117 -21.671 -5.829 -2.225 1.00 0.00 H new ATOM 0 HA ARG B 117 -24.191 -6.979 -2.430 1.00 0.00 H new ATOM 0 HB2 ARG B 117 -25.613 -5.378 -1.254 1.00 0.00 H new ATOM 0 HB3 ARG B 117 -24.596 -6.252 -0.126 1.00 0.00 H new ATOM 0 HG2 ARG B 117 -23.042 -4.307 -0.029 1.00 0.00 H new ATOM 0 HG3 ARG B 117 -24.076 -3.433 -1.142 1.00 0.00 H new ATOM 0 HD2 ARG B 117 -24.867 -4.442 1.620 1.00 0.00 H new ATOM 0 HD3 ARG B 117 -24.536 -2.776 1.188 1.00 0.00 H new ATOM 0 HE ARG B 117 -26.590 -3.733 -0.544 1.00 0.00 H new ATOM 0 HH11 ARG B 117 -26.024 -2.974 2.860 1.00 0.00 H new ATOM 0 HH12 ARG B 117 -27.715 -2.567 3.169 1.00 0.00 H new ATOM 0 HH21 ARG B 117 -28.758 -3.206 -0.137 1.00 0.00 H new ATOM 0 HH22 ARG B 117 -29.256 -2.697 1.480 1.00 0.00 H new ATOM 1849 N ALA B 118 -22.779 -4.125 -3.203 1.00 0.00 N ATOM 1850 CA ALA B 118 -22.647 -3.097 -4.228 1.00 0.00 C ATOM 1851 C ALA B 118 -23.880 -2.199 -4.269 1.00 0.00 C ATOM 1852 O ALA B 118 -24.424 -1.832 -3.226 1.00 0.00 O ATOM 1853 CB ALA B 118 -22.396 -3.738 -5.586 1.00 0.00 C ATOM 0 H ALA B 118 -22.069 -4.079 -2.472 1.00 0.00 H new ATOM 0 HA ALA B 118 -21.792 -2.470 -3.977 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -22.299 -2.960 -6.343 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -21.477 -4.323 -5.548 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -23.232 -4.390 -5.841 1.00 0.00 H new ATOM 1859 N GLY B 119 -24.317 -1.845 -5.474 1.00 0.00 N ATOM 1860 CA GLY B 119 -25.481 -0.991 -5.618 1.00 0.00 C ATOM 1861 C GLY B 119 -25.835 -0.737 -7.070 1.00 0.00 C ATOM 1862 O GLY B 119 -27.005 -0.785 -7.448 1.00 0.00 O ATOM 0 H GLY B 119 -23.886 -2.134 -6.352 1.00 0.00 H new ATOM 0 HA2 GLY B 119 -26.331 -1.452 -5.115 1.00 0.00 H new ATOM 0 HA3 GLY B 119 -25.294 -0.039 -5.121 1.00 0.00 H new ATOM 1866 N GLU B 120 -24.818 -0.468 -7.885 1.00 0.00 N ATOM 1867 CA GLU B 120 -25.023 -0.205 -9.304 1.00 0.00 C ATOM 1868 C GLU B 120 -23.688 -0.093 -10.033 1.00 0.00 C ATOM 1869 O GLU B 120 -23.415 -0.947 -10.902 1.00 0.00 O ATOM 1870 CB GLU B 120 -25.831 1.080 -9.497 1.00 0.00 C ATOM 1871 CG GLU B 120 -26.153 1.387 -10.950 1.00 0.00 C ATOM 1872 CD GLU B 120 -26.942 2.671 -11.117 1.00 0.00 C ATOM 1873 OE1 GLU B 120 -27.189 3.354 -10.101 1.00 0.00 O ATOM 1874 OE2 GLU B 120 -27.311 2.995 -12.264 1.00 0.00 O ATOM 1875 OXT GLU B 120 -22.926 0.850 -9.729 1.00 0.00 O ATOM 0 H GLU B 120 -23.844 -0.427 -7.585 1.00 0.00 H new ATOM 0 HA GLU B 120 -25.580 -1.042 -9.726 1.00 0.00 H new ATOM 0 HB2 GLU B 120 -26.763 1.000 -8.937 1.00 0.00 H new ATOM 0 HB3 GLU B 120 -25.274 1.916 -9.073 1.00 0.00 H new ATOM 0 HG2 GLU B 120 -25.224 1.460 -11.516 1.00 0.00 H new ATOM 0 HG3 GLU B 120 -26.721 0.559 -11.375 1.00 0.00 H new TER 1882 GLU B 120